1,3,4,6,7,8,9,10,11-nonadeuterio-2-[1,2,3,4,5,6,7,8-octadeuterio-10-[2,3,4,5,6,7,8-heptadeuterio-9,9-bis(trideuteriomethyl)fluoren-1-yl]anthracen-9-yl]naphtho[2,3-b][1]benzofuran;1,3,4,6,7,8,9,10,11-nonadeuterio-2-[1,2,3,4,5,6,7,8-octadeuterio-10-(1,2,3,5,6,7,8-heptadeuterio-9,9-dimethylfluoren-4-yl)anthracen-9-yl]naphtho[2,3-b][1]benzofuran;1,3,4,6,7,8,9,10,11-nonadeuterio-2-[1,2,3,4,5,6,7,8-octadeuterio-10-(1,2,4,5,6,7,8-heptadeuterio-9,9-dimethylfluoren-3-yl)anthracen-9-yl]naphtho[2,3-b][1]benzofuran;1,3,4,6,7,8,9,10,11-nonadeuterio-2-[1,2,3,4,5,6,7,8-octadeuterio-10-[1,3,4,5,6,7,8-heptadeuterio-9-methyl-9-(trideuteriomethyl)fluoren-2-yl]anthracen-9-yl]naphtho[2,3-b][1]benzofuran

C180H120O4 — CID 159174482

IUPAC1,3,4,6,7,8,9,10,11-nonadeuterio-2-[1,2,3,4,5,6,7,8-octadeuterio-10-[2,3,4,5,6,7,8-heptadeuterio-9,9-bis(trideuteriomethyl)fluoren-1-yl]anthracen-9-yl]naphtho[2,3-b][1]benzofuran;1,3,4,6,7,8,9,10,11-nonadeuterio-2-[1,2,3,4,5,6,7,8-octadeuterio-10-(1,2,3,5,6,7,8-heptadeuterio-9,9-dimethylfluoren-4-yl)anthracen-9-yl]naphtho[2,3-b][1]benzofuran;1,3,4,6,7,8,9,10,11-nonadeuterio-2-[1,2,3,4,5,6,7,8-octadeuterio-10-(1,2,4,5,6,7,8-heptadeuterio-9,9-dimethylfluoren-3-yl)anthracen-9-yl]naphtho[2,3-b][1]benzofuran;1,3,4,6,7,8,9,10,11-nonadeuterio-2-[1,2,3,4,5,6,7,8-octadeuterio-10-[1,3,4,5,6,7,8-heptadeuterio-9-methyl-9-(trideuteriomethyl)fluoren-2-yl]anthracen-9-yl]naphtho[2,3-b][1]benzofuran
SMILES[2H]c1c([2H])c([2H])c2c(c1[2H])-c1c(-c3c4c([2H])c([2H])c([2H])c([2H])c4c(-c4c([2H])c([2H])c5oc6c([2H])c7c([2H])c([2H])c([2H])c([2H])c7c([2H])c6c5c4[2H])c4c([2H])c([2H])c([2H])c([2H])c34)c([2H])c([2H])c([2H])c1C2(C)C.[2H]c1c([2H])c([2H])c2c(c1[2H])-c1c([2H])c(-c3c4c([2H])c([2H])c([2H])c([2H])c4c(-c4c([2H])c([2H])c5oc6c([2H])c7c([2H])c([2H])c([2H])c([2H])c7c([2H])c6c5c4[2H])c4c([2H])c([2H])c([2H])c([2H])c34)c([2H])c([2H])c1C2(C)C.[2H]c1c([2H])c([2H])c2c(c1[2H])-c1c([2H])c([2H])c(-c3c4c([2H])c([2H])c([2H])c([2H])c4c(-c4c([2H])c([2H])c5oc6c([2H])c7c([2H])c([2H])c([2H])c([2H])c7c([2H])c6c5c4[2H])c4c([2H])c([2H])c([2H])c([2H])c34)c([2H])c1C2(C)C([2H])([2H])[2H].[2H]c1c([2H])c([2H])c2c(c1[2H])-c1c([2H])c([2H])c([2H])c(-c3c4c([2H])c([2H])c([2H])c([2H])c4c(-c4c([2H])c([2H])c5oc6c([2H])c7c([2H])c([2H])c([2H])c([2H])c7c([2H])c6c5c4[2H])c4c([2H])c([2H])c([2H])c([2H])c34)c1C2(C([2H])([2H])[2H])C([2H])([2H])[2H]
InChIInChI=1S/4C45H30O/c1-45(2)39-21-10-9-14-30(39)35-19-11-20-36(44(35)45)43-33-17-7-5-15-31(33)42(32-16-6-8-18-34(32)43)29-22-23-40-37(25-29)38-24-27-12-3-4-13-28(27)26-41(38)46-40;1-45(2)38-20-10-9-18-34(38)44-35(19-11-21-39(44)45)43-32-16-7-5-14-30(32)42(31-15-6-8-17-33(31)43)29-22-23-40-36(25-29)37-24-27-12-3-4-13-28(27)26-41(37)46-40;1-45(2)39-18-10-9-13-31(39)32-21-19-30(25-40(32)45)44-35-16-7-5-14-33(35)43(34-15-6-8-17-36(34)44)29-20-22-41-37(24-29)38-23-27-11-3-4-12-28(27)26-42(38)46-41;1-45(2)39-18-10-9-13-31(39)36-24-29(19-21-40(36)45)43-32-14-5-7-16-34(32)44(35-17-8-6-15-33(35)43)30-20-22-41-37(25-30)38-23-27-11-3-4-12-28(27)26-42(38)46-41/h4*3-26H,1-2H3/i1D3,2D3,3D,4D,5D,6D,7D,8D,9D,10D,11D,12D,13D,14D,15D,16D,17D,18D,19D,20D,21D,22D,23D,24D,25D,26D;3D,4D,5D,6D,7D,8D,9D,10D,11D,12D,13D,14D,15D,16D,17D,18D,19D,20D,21D,22D,23D,24D,25D,26D;1D3,3D,4D,5D,6D,7D,8D,9D,10D,11D,12D,13D,14D,15D,16D,17D,18D,19D,20D,21D,22D,23D,24D,25D,26D;3D,4D,5D,6D,7D,8D,9D,10D,11D,12D,13D,14D,15D,16D,17D,18D,19D,20D,21D,22D,23D,24D,25D,26D
InChIKeyKMCJOJGSKCZTNE-NDIJJRPESA-N
MW2452.58 g/mol
LogP50.74
Rot. Bonds11

About 1,3,4,6,7,8,9,10,11-nonadeuterio-2-[1,2,3,4,5,6,7,8-octadeuterio-10-[2,3,4,5,6,7,8-heptadeuterio-9,9-bis(trideuteriomethyl)fluoren-1-yl]anthracen-9-yl]naphtho[2,3-b][1]benzofuran;1,3,4,6,7,8,9,10,11-nonadeuterio-2-[1,2,3,4,5,6,7,8-octadeuterio-10-(1,2,3,5,6,7,8-heptadeuterio-9,9-dimethylfluoren-4-yl)anthracen-9-yl]naphtho[2,3-b][1]benzofuran;1,3,4,6,7,8,9,10,11-nonadeuterio-2-[1,2,3,4,5,6,7,8-octadeuterio-10-(1,2,4,5,6,7,8-heptadeuterio-9,9-dimethylfluoren-3-yl)anthracen-9-yl]naphtho[2,3-b][1]benzofuran;1,3,4,6,7,8,9,10,11-nonadeuterio-2-[1,2,3,4,5,6,7,8-octadeuterio-10-[1,3,4,5,6,7,8-heptadeuterio-9-methyl-9-(trideuteriomethyl)fluoren-2-yl]anthracen-9-yl]naphtho[2,3-b][1]benzofuran

1,3,4,6,7,8,9,10,11-nonadeuterio-2-[1,2,3,4,5,6,7,8-octadeuterio-10-[2,3,4,5,6,7,8-heptadeuterio-9,9-bis(trideuteriomethyl)fluoren-1-yl]anthracen-9-yl]naphtho[2,3-b][1]benzofuran;1,3,4,6,7,8,9,10,11-nonadeuterio-2-[1,2,3,4,5,6,7,8-octadeuterio-10-(1,2,3,5,6,7,8-heptadeuterio-9,9-dimethylfluoren-4-yl)anthracen-9-yl]naphtho[2,3-b][1]benzofuran;1,3,4,6,7,8,9,10,11-nonadeuterio-2-[1,2,3,4,5,6,7,8-octadeuterio-10-(1,2,4,5,6,7,8-heptadeuterio-9,9-dimethylfluoren-3-yl)anthracen-9-yl]naphtho[2,3-b][1]benzofuran;1,3,4,6,7,8,9,10,11-nonadeuterio-2-[1,2,3,4,5,6,7,8-octadeuterio-10-[1,3,4,5,6,7,8-heptadeuterio-9-methyl-9-(trideuteriomethyl)fluoren-2-yl]anthracen-9-yl]naphtho[2,3-b][1]benzofuran (PubChem CID 159174482) has the molecular formula C180H120O4 and a molecular weight of 2452.58 g/mol. Its IUPAC name is 1,3,4,6,7,8,9,10,11-nonadeuterio-2-[1,2,3,4,5,6,7,8-octadeuterio-10-[2,3,4,5,6,7,8-heptadeuterio-9,9-bis(trideuteriomethyl)fluoren-1-yl]anthracen-9-yl]naphtho[2,3-b][1]benzofuran;1,3,4,6,7,8,9,10,11-nonadeuterio-2-[1,2,3,4,5,6,7,8-octadeuterio-10-(1,2,3,5,6,7,8-heptadeuterio-9,9-dimethylfluoren-4-yl)anthracen-9-yl]naphtho[2,3-b][1]benzofuran;1,3,4,6,7,8,9,10,11-nonadeuterio-2-[1,2,3,4,5,6,7,8-octadeuterio-10-(1,2,4,5,6,7,8-heptadeuterio-9,9-dimethylfluoren-3-yl)anthracen-9-yl]naphtho[2,3-b][1]benzofuran;1,3,4,6,7,8,9,10,11-nonadeuterio-2-[1,2,3,4,5,6,7,8-octadeuterio-10-[1,3,4,5,6,7,8-heptadeuterio-9-methyl-9-(trideuteriomethyl)fluoren-2-yl]anthracen-9-yl]naphtho[2,3-b][1]benzofuran.

Molecular Properties

Compound Name1,3,4,6,7,8,9,10,11-nonadeuterio-2-[1,2,3,4,5,6,7,8-octadeuterio-10-[2,3,4,5,6,7,8-heptadeuterio-9,9-bis(trideuteriomethyl)fluoren-1-yl]anthracen-9-yl]naphtho[2,3-b][1]benzofuran;1,3,4,6,7,8,9,10,11-nonadeuterio-2-[1,2,3,4,5,6,7,8-octadeuterio-10-(1,2,3,5,6,7,8-heptadeuterio-9,9-dimethylfluoren-4-yl)anthracen-9-yl]naphtho[2,3-b][1]benzofuran;1,3,4,6,7,8,9,10,11-nonadeuterio-2-[1,2,3,4,5,6,7,8-octadeuterio-10-(1,2,4,5,6,7,8-heptadeuterio-9,9-dimethylfluoren-3-yl)anthracen-9-yl]naphtho[2,3-b][1]benzofuran;1,3,4,6,7,8,9,10,11-nonadeuterio-2-[1,2,3,4,5,6,7,8-octadeuterio-10-[1,3,4,5,6,7,8-heptadeuterio-9-methyl-9-(trideuteriomethyl)fluoren-2-yl]anthracen-9-yl]naphtho[2,3-b][1]benzofuran
PubChem CID159174482
Molecular FormulaC180H120O4
Molecular Weight2452.58 g/mol
Exact Mass2450.58
IUPAC Name1,3,4,6,7,8,9,10,11-nonadeuterio-2-[1,2,3,4,5,6,7,8-octadeuterio-10-[2,3,4,5,6,7,8-heptadeuterio-9,9-bis(trideuteriomethyl)fluoren-1-yl]anthracen-9-yl]naphtho[2,3-b][1]benzofuran;1,3,4,6,7,8,9,10,11-nonadeuterio-2-[1,2,3,4,5,6,7,8-octadeuterio-10-(1,2,3,5,6,7,8-heptadeuterio-9,9-dimethylfluoren-4-yl)anthracen-9-yl]naphtho[2,3-b][1]benzofuran;1,3,4,6,7,8,9,10,11-nonadeuterio-2-[1,2,3,4,5,6,7,8-octadeuterio-10-(1,2,4,5,6,7,8-heptadeuterio-9,9-dimethylfluoren-3-yl)anthracen-9-yl]naphtho[2,3-b][1]benzofuran;1,3,4,6,7,8,9,10,11-nonadeuterio-2-[1,2,3,4,5,6,7,8-octadeuterio-10-[1,3,4,5,6,7,8-heptadeuterio-9-methyl-9-(trideuteriomethyl)fluoren-2-yl]anthracen-9-yl]naphtho[2,3-b][1]benzofuran
SMILES[2H]c1c([2H])c([2H])c2c(c1[2H])-c1c(-c3c4c([2H])c([2H])c([2H])c([2H])c4c(-c4c([2H])c([2H])c5oc6c([2H])c7c([2H])c([2H])c([2H])c([2H])c7c([2H])c6c5c4[2H])c4c([2H])c([2H])c([2H])c([2H])c34)c([2H])c([2H])c([2H])c1C2(C)C.[2H]c1c([2H])c([2H])c2c(c1[2H])-c1c([2H])c(-c3c4c([2H])c([2H])c([2H])c([2H])c4c(-c4c([2H])c([2H])c5oc6c([2H])c7c([2H])c([2H])c([2H])c([2H])c7c([2H])c6c5c4[2H])c4c([2H])c([2H])c([2H])c([2H])c34)c([2H])c([2H])c1C2(C)C.[2H]c1c([2H])c([2H])c2c(c1[2H])-c1c([2H])c([2H])c(-c3c4c([2H])c([2H])c([2H])c([2H])c4c(-c4c([2H])c([2H])c5oc6c([2H])c7c([2H])c([2H])c([2H])c([2H])c7c([2H])c6c5c4[2H])c4c([2H])c([2H])c([2H])c([2H])c34)c([2H])c1C2(C)C([2H])([2H])[2H].[2H]c1c([2H])c([2H])c2c(c1[2H])-c1c([2H])c([2H])c([2H])c(-c3c4c([2H])c([2H])c([2H])c([2H])c4c(-c4c([2H])c([2H])c5oc6c([2H])c7c([2H])c([2H])c([2H])c([2H])c7c([2H])c6c5c4[2H])c4c([2H])c([2H])c([2H])c([2H])c34)c1C2(C([2H])([2H])[2H])C([2H])([2H])[2H]
InChIInChI=1S/4C45H30O/c1-45(2)39-21-10-9-14-30(39)35-19-11-20-36(44(35)45)43-33-17-7-5-15-31(33)42(32-16-6-8-18-34(32)43)29-22-23-40-37(25-29)38-24-27-12-3-4-13-28(27)26-41(38)46-40;1-45(2)38-20-10-9-18-34(38)44-35(19-11-21-39(44)45)43-32-16-7-5-14-30(32)42(31-15-6-8-17-33(31)43)29-22-23-40-36(25-29)37-24-27-12-3-4-13-28(27)26-41(37)46-40;1-45(2)39-18-10-9-13-31(39)32-21-19-30(25-40(32)45)44-35-16-7-5-14-33(35)43(34-15-6-8-17-36(34)44)29-20-22-41-37(24-29)38-23-27-11-3-4-12-28(27)26-42(38)46-41;1-45(2)39-18-10-9-13-31(39)36-24-29(19-21-40(36)45)43-32-14-5-7-16-34(32)44(35-17-8-6-15-33(35)43)30-20-22-41-37(25-30)38-23-27-11-3-4-12-28(27)26-42(38)46-41/h4*3-26H,1-2H3/i1D3,2D3,3D,4D,5D,6D,7D,8D,9D,10D,11D,12D,13D,14D,15D,16D,17D,18D,19D,20D,21D,22D,23D,24D,25D,26D;3D,4D,5D,6D,7D,8D,9D,10D,11D,12D,13D,14D,15D,16D,17D,18D,19D,20D,21D,22D,23D,24D,25D,26D;1D3,3D,4D,5D,6D,7D,8D,9D,10D,11D,12D,13D,14D,15D,16D,17D,18D,19D,20D,21D,22D,23D,24D,25D,26D;3D,4D,5D,6D,7D,8D,9D,10D,11D,12D,13D,14D,15D,16D,17D,18D,19D,20D,21D,22D,23D,24D,25D,26D
InChIKeyKMCJOJGSKCZTNE-NDIJJRPESA-N
XLogP50.74
TPSA52.56 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds11
Heavy Atoms184
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5002452.58
LogP ≤ 550.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 1,3,4,6,7,8,9,10,11-nonadeuterio-2-[1,2,3,4,5,6,7,8-octadeuterio-10-[2,3,4,5,6,7,8-heptadeuterio-9,9-bis(trideuteriomethyl)fluoren-1-yl]anthracen-9-yl]naphtho[2,3-b][1]benzofuran;1,3,4,6,7,8,9,10,11-nonadeuterio-2-[1,2,3,4,5,6,7,8-octadeuterio-10-(1,2,3,5,6,7,8-heptadeuterio-9,9-dimethylfluoren-4-yl)anthracen-9-yl]naphtho[2,3-b][1]benzofuran;1,3,4,6,7,8,9,10,11-nonadeuterio-2-[1,2,3,4,5,6,7,8-octadeuterio-10-(1,2,4,5,6,7,8-heptadeuterio-9,9-dimethylfluoren-3-yl)anthracen-9-yl]naphtho[2,3-b][1]benzofuran;1,3,4,6,7,8,9,10,11-nonadeuterio-2-[1,2,3,4,5,6,7,8-octadeuterio-10-[1,3,4,5,6,7,8-heptadeuterio-9-methyl-9-(trideuteriomethyl)fluoren-2-yl]anthracen-9-yl]naphtho[2,3-b][1]benzofuran with MolForge

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Related Compounds

1,3,4,6,7,8,9,10,11-nonadeuterio-2-[1,2,3,4,5,6,7,8-octadeuterio-10-[2,3,4,6-tetradeuterio-5-(1,2,3,5,6,7,8-heptadeuterio-9,9-dimethylfluoren-4-yl)phenyl]anthracen-9-yl]naphtho[2,3-b][1]benzofuran;1,3,4,6,7,8,9,10,11-nonadeuterio-2-[1,2,3,4,5,6,7,8-octadeuterio-10-[2,3,4,6-tetradeuterio-5-(1,3,4,5,6,7,8-heptadeuterio-9,9-dimethylfluoren-2-yl)phenyl]anthracen-9-yl]naphtho[2,3-b][1]benzofuran;1,3,4,6,7,8,9,10,11-nonadeuterio-2-[1,2,3,4,5,6,7,8-octadeuterio-10-[2,3,4,6-tetradeuterio-5-[1,2,4,5,6,7,8-heptadeuterio-9-methyl-9-(trideuteriomethyl)fluoren-3-yl]phenyl]anthracen-9-yl]naphtho[2,3-b][1]benzofuran
CID 159887161
1,2,3,4,6,7,9-heptadeuterio-8-[1,2,3,4,5,6,7,8-octadeuterio-10-[2,3,4,6-tetradeuterio-5-(1,2,3,5,6,7,8-heptadeuterio-9,9-dimethylfluoren-4-yl)phenyl]anthracen-9-yl]dibenzofuran;1,2,3,4,6,7,9-heptadeuterio-8-[1,2,3,4,5,6,7,8-octadeuterio-10-[2,3,4,6-tetradeuterio-5-(1,2,4,5,6,7,8-heptadeuterio-9,9-dimethylfluoren-3-yl)phenyl]anthracen-9-yl]dibenzofuran;1,2,3,4,6,7,9-heptadeuterio-8-[1,2,3,4,5,6,7,8-octadeuterio-10-[2,3,4,6-tetradeuterio-5-(1,3,4,5,6,7,8-heptadeuterio-9,9-dimethylfluoren-2-yl)phenyl]anthracen-9-yl]dibenzofuran;1,2,3,4,6,7,9-heptadeuterio-8-[1,2,3,4,5,6,7,8-octadeuterio-10-[2,3,4,6-tetradeuterio-5-(2,3,4,5,6,7,8-heptadeuterio-9,9-dimethylfluoren-1-yl)phenyl]anthracen-9-yl]dibenzofuran
CID 159668360
1,3,4,6,7,8,9,10,11-nonadeuterio-2-[1,2,3,4,5,6,7,8-octadeuterio-10-[2,3,4,6-tetradeuterio-5-(1,2,3,5,6,7,8-heptadeuterio-9,9-dimethylfluoren-4-yl)phenyl]anthracen-9-yl]naphtho[2,3-b][1]benzofuran
CID 159887162
1,2,3,4,6,7,9-heptadeuterio-8-[1,2,3,4,5,6,7,8-octadeuterio-10-[2,3,4,5,6,7,8-heptadeuterio-9,9-bis(trideuteriomethyl)fluoren-1-yl]anthracen-9-yl]dibenzofuran
CID 155625161
1,2,3,4,6,7,8-heptadeuterio-9-[1,2,3,4,5,6,7,8-octadeuterio-10-[2,3,4,6-tetradeuterio-5-(1,3,4,5,6,7,8-heptadeuterio-9,9-dimethylfluoren-2-yl)phenyl]anthracen-9-yl]dibenzofuran;1,2,3,4,6,7,8-heptadeuterio-9-[1,2,3,4,5,6,7,8-octadeuterio-10-[2,3,5,6-tetradeuterio-4-(1,2,4,5,6,7,8-heptadeuterio-9,9-dimethylfluoren-3-yl)phenyl]anthracen-9-yl]dibenzofuran;1,2,3,4,6,7,8-heptadeuterio-9-[1,2,3,4,5,6,7,8-octadeuterio-10-[2,3,4,6-tetradeuterio-5-[2,3,4,5,6,7,8-heptadeuterio-9-methyl-9-(trideuteriomethyl)fluoren-1-yl]phenyl]anthracen-9-yl]dibenzofuran;1,2,3,4,6,7,8-heptadeuterio-9-[1,2,3,4,5,6,7,8-octadeuterio-10-[2,3,5,6-tetradeuterio-4-(1,2,3,5,6,7-hexadeuterio-9,9-dimethylfluoren-4-yl)phenyl]anthracen-9-yl]dibenzofuran
CID 161439182
1,2,3,4,5,6,8,9,11-nonadeuterio-10-[1,2,3,4,5,6,7,8-octadeuterio-10-[1,3,4,5,6,7,8-heptadeuterio-9-methyl-9-(trideuteriomethyl)fluoren-2-yl]anthracen-9-yl]naphtho[2,1-b][1]benzofuran
CID 157130704
1,2,3,4,5,6,7,9,10-nonadeuterio-8-[1,2,3,4,5,6,7,8-octadeuterio-10-[2,3,4,6-tetradeuterio-5-[2,3,4,5,6,7,8-heptadeuterio-9-methyl-9-(trideuteriomethyl)fluoren-1-yl]phenyl]anthracen-9-yl]naphtho[1,2-b][1]benzofuran
CID 158117383
1,2,3,4,5,6,8,9,11-nonadeuterio-10-[1,2,3,4,5,6,7,8-octadeuterio-10-(1,3,4,5,6,7,8-heptadeuterio-9,9-dimethylfluoren-2-yl)anthracen-9-yl]naphtho[2,1-b][1]benzofuran
CID 171450962
1,2,3,4,5,6,8,9,11-nonadeuterio-10-(1,2,3,4,5,6,7,8-octadeuterio-10-naphthalen-1-ylanthracen-9-yl)naphtho[2,1-b][1]benzofuran;1,2,3,4,5,6,8,9,11-nonadeuterio-10-(1,2,3,4,5,6,7,8-octadeuterio-10-phenylanthracen-9-yl)naphtho[2,1-b][1]benzofuran;10-[1,2,3,4,5,6,7,8-octadeuterio-10-(1,2,3,5,6,7,8-heptadeuterio-9,9-dimethylfluoren-4-yl)anthracen-9-yl]naphtho[2,1-b][1]benzofuran;10-[1,2,3,4,5,6,7,8-octadeuterio-10-(1,2,4,5,6,7,8-heptadeuterio-9,9-dimethylfluoren-3-yl)anthracen-9-yl]naphtho[2,1-b][1]benzofuran
CID 161039164
1,2,3,4,5,6,8,9,10-nonadeuterio-7-[2,3,5,6-tetradeuterio-4-[1,2,3,4,5,6,7,8-octadeuterio-10-(1,2,3,5,6,7,8-heptadeuterio-9,9-dimethylfluoren-4-yl)anthracen-9-yl]phenyl]naphtho[1,2-b][1]benzofuran;1,2,3,4,5,6,8,9,10-nonadeuterio-7-[2,3,5,6-tetradeuterio-4-[1,2,3,4,5,6,7,8-octadeuterio-10-(1,2,4,5,6,7,8-heptadeuterio-9,9-dimethylfluoren-3-yl)anthracen-9-yl]phenyl]naphtho[1,2-b][1]benzofuran;1,2,3,4,5,6,8,9,10-nonadeuterio-7-[2,3,5,6-tetradeuterio-4-[1,2,3,4,5,6,7,8-octadeuterio-10-[1,3,4,5,6,7,8-heptadeuterio-9-methyl-9-(trideuteriomethyl)fluoren-2-yl]anthracen-9-yl]phenyl]naphtho[1,2-b][1]benzofuran;1,2,3,4,5,6,8,9,10-nonadeuterio-7-[2,3,5,6-tetradeuterio-4-[1,2,3,4,5,6,7,8-octadeuterio-10-(1,3,4,5,6,7,8,9,10-nonadeuteriophenanthren-2-yl)anthracen-9-yl]phenyl]naphtho[1,2-b][1]benzofuran;1,2,3,4,5,6,8,9,10-nonadeuterio-7-[2,3,5,6-tetradeuterio-4-[1,2,3,4,5,6,7,8-octadeuterio-10-[2,3,4,5-tetradeuterio-6-(2,3,4,5,6-pentadeuteriophenyl)phenyl]anthracen-9-yl]phenyl]naphtho[1,2-b][1]benzofuran;1,2,3,4,5,6,8,9,10-nonadeuterio-7-[2,3,5,6-tetradeuterio-4-[1,2,3,4,5,6,7,8-octadeuterio-10-[2,3,4,6-tetradeuterio-5-(2,3,4,5,6-pentadeuteriophenyl)phenyl]anthracen-9-yl]phenyl]naphtho[1,2-b][1]benzofuran;1,2,3,4,5,6,8,9,10-nonadeuterio-7-[2,3,5,6-tetradeuterio-4-[1,2,3,4,5,6,7,8-octadeuterio-10-[2,3,5,6-tetradeuterio-4-(2,3,4,5,6-pentadeuteriophenyl)phenyl]anthracen-9-yl]phenyl]naphtho[1,2-b][1]benzofuran
CID 159532875
1,2,3,4,6,7,8-heptadeuterio-9-[2,3,5,6-tetradeuterio-4-[1,2,3,4,5,6,7,8-octadeuterio-10-(1,2,4,5,6,7,8-heptadeuterio-9,9-dimethylfluoren-3-yl)anthracen-9-yl]phenyl]dibenzofuran
CID 159302705
1,3,4,6,7,8,9,10,11-nonadeuterio-2-[1,2,3,4,5,6,7,8-octadeuterio-10-(2-phenylphenyl)anthracen-9-yl]naphtho[2,3-b][1]benzofuran
CID 153473565

Frequently Asked Questions

What is the IUPAC name of 1,3,4,6,7,8,9,10,11-nonadeuterio-2-[1,2,3,4,5,6,7,8-octadeuterio-10-[2,3,4,5,6,7,8-heptadeuterio-9,9-bis(trideuteriomethyl)fluoren-1-yl]anthracen-9-yl]naphtho[2,3-b][1]benzofuran;1,3,4,6,7,8,9,10,11-nonadeuterio-2-[1,2,3,4,5,6,7,8-octadeuterio-10-(1,2,3,5,6,7,8-heptadeuterio-9,9-dimethylfluoren-4-yl)anthracen-9-yl]naphtho[2,3-b][1]benzofuran;1,3,4,6,7,8,9,10,11-nonadeuterio-2-[1,2,3,4,5,6,7,8-octadeuterio-10-(1,2,4,5,6,7,8-heptadeuterio-9,9-dimethylfluoren-3-yl)anthracen-9-yl]naphtho[2,3-b][1]benzofuran;1,3,4,6,7,8,9,10,11-nonadeuterio-2-[1,2,3,4,5,6,7,8-octadeuterio-10-[1,3,4,5,6,7,8-heptadeuterio-9-methyl-9-(trideuteriomethyl)fluoren-2-yl]anthracen-9-yl]naphtho[2,3-b][1]benzofuran?
The IUPAC name of 1,3,4,6,7,8,9,10,11-nonadeuterio-2-[1,2,3,4,5,6,7,8-octadeuterio-10-[2,3,4,5,6,7,8-heptadeuterio-9,9-bis(trideuteriomethyl)fluoren-1-yl]anthracen-9-yl]naphtho[2,3-b][1]benzofuran;1,3,4,6,7,8,9,10,11-nonadeuterio-2-[1,2,3,4,5,6,7,8-octadeuterio-10-(1,2,3,5,6,7,8-heptadeuterio-9,9-dimethylfluoren-4-yl)anthracen-9-yl]naphtho[2,3-b][1]benzofuran;1,3,4,6,7,8,9,10,11-nonadeuterio-2-[1,2,3,4,5,6,7,8-octadeuterio-10-(1,2,4,5,6,7,8-heptadeuterio-9,9-dimethylfluoren-3-yl)anthracen-9-yl]naphtho[2,3-b][1]benzofuran;1,3,4,6,7,8,9,10,11-nonadeuterio-2-[1,2,3,4,5,6,7,8-octadeuterio-10-[1,3,4,5,6,7,8-heptadeuterio-9-methyl-9-(trideuteriomethyl)fluoren-2-yl]anthracen-9-yl]naphtho[2,3-b][1]benzofuran (CID 159174482) is 1,3,4,6,7,8,9,10,11-nonadeuterio-2-[1,2,3,4,5,6,7,8-octadeuterio-10-[2,3,4,5,6,7,8-heptadeuterio-9,9-bis(trideuteriomethyl)fluoren-1-yl]anthracen-9-yl]naphtho[2,3-b][1]benzofuran;1,3,4,6,7,8,9,10,11-nonadeuterio-2-[1,2,3,4,5,6,7,8-octadeuterio-10-(1,2,3,5,6,7,8-heptadeuterio-9,9-dimethylfluoren-4-yl)anthracen-9-yl]naphtho[2,3-b][1]benzofuran;1,3,4,6,7,8,9,10,11-nonadeuterio-2-[1,2,3,4,5,6,7,8-octadeuterio-10-(1,2,4,5,6,7,8-heptadeuterio-9,9-dimethylfluoren-3-yl)anthracen-9-yl]naphtho[2,3-b][1]benzofuran;1,3,4,6,7,8,9,10,11-nonadeuterio-2-[1,2,3,4,5,6,7,8-octadeuterio-10-[1,3,4,5,6,7,8-heptadeuterio-9-methyl-9-(trideuteriomethyl)fluoren-2-yl]anthracen-9-yl]naphtho[2,3-b][1]benzofuran.
What is the SMILES notation for 1,3,4,6,7,8,9,10,11-nonadeuterio-2-[1,2,3,4,5,6,7,8-octadeuterio-10-[2,3,4,5,6,7,8-heptadeuterio-9,9-bis(trideuteriomethyl)fluoren-1-yl]anthracen-9-yl]naphtho[2,3-b][1]benzofuran;1,3,4,6,7,8,9,10,11-nonadeuterio-2-[1,2,3,4,5,6,7,8-octadeuterio-10-(1,2,3,5,6,7,8-heptadeuterio-9,9-dimethylfluoren-4-yl)anthracen-9-yl]naphtho[2,3-b][1]benzofuran;1,3,4,6,7,8,9,10,11-nonadeuterio-2-[1,2,3,4,5,6,7,8-octadeuterio-10-(1,2,4,5,6,7,8-heptadeuterio-9,9-dimethylfluoren-3-yl)anthracen-9-yl]naphtho[2,3-b][1]benzofuran;1,3,4,6,7,8,9,10,11-nonadeuterio-2-[1,2,3,4,5,6,7,8-octadeuterio-10-[1,3,4,5,6,7,8-heptadeuterio-9-methyl-9-(trideuteriomethyl)fluoren-2-yl]anthracen-9-yl]naphtho[2,3-b][1]benzofuran?
The canonical SMILES for 1,3,4,6,7,8,9,10,11-nonadeuterio-2-[1,2,3,4,5,6,7,8-octadeuterio-10-[2,3,4,5,6,7,8-heptadeuterio-9,9-bis(trideuteriomethyl)fluoren-1-yl]anthracen-9-yl]naphtho[2,3-b][1]benzofuran;1,3,4,6,7,8,9,10,11-nonadeuterio-2-[1,2,3,4,5,6,7,8-octadeuterio-10-(1,2,3,5,6,7,8-heptadeuterio-9,9-dimethylfluoren-4-yl)anthracen-9-yl]naphtho[2,3-b][1]benzofuran;1,3,4,6,7,8,9,10,11-nonadeuterio-2-[1,2,3,4,5,6,7,8-octadeuterio-10-(1,2,4,5,6,7,8-heptadeuterio-9,9-dimethylfluoren-3-yl)anthracen-9-yl]naphtho[2,3-b][1]benzofuran;1,3,4,6,7,8,9,10,11-nonadeuterio-2-[1,2,3,4,5,6,7,8-octadeuterio-10-[1,3,4,5,6,7,8-heptadeuterio-9-methyl-9-(trideuteriomethyl)fluoren-2-yl]anthracen-9-yl]naphtho[2,3-b][1]benzofuran is [2H]c1c([2H])c([2H])c2c(c1[2H])-c1c(-c3c4c([2H])c([2H])c([2H])c([2H])c4c(-c4c([2H])c([2H])c5oc6c([2H])c7c([2H])c([2H])c([2H])c([2H])c7c([2H])c6c5c4[2H])c4c([2H])c([2H])c([2H])c([2H])c34)c([2H])c([2H])c([2H])c1C2(C)C.[2H]c1c([2H])c([2H])c2c(c1[2H])-c1c([2H])c(-c3c4c([2H])c([2H])c([2H])c([2H])c4c(-c4c([2H])c([2H])c5oc6c([2H])c7c([2H])c([2H])c([2H])c([2H])c7c([2H])c6c5c4[2H])c4c([2H])c([2H])c([2H])c([2H])c34)c([2H])c([2H])c1C2(C)C.[2H]c1c([2H])c([2H])c2c(c1[2H])-c1c([2H])c([2H])c(-c3c4c([2H])c([2H])c([2H])c([2H])c4c(-c4c([2H])c([2H])c5oc6c([2H])c7c([2H])c([2H])c([2H])c([2H])c7c([2H])c6c5c4[2H])c4c([2H])c([2H])c([2H])c([2H])c34)c([2H])c1C2(C)C([2H])([2H])[2H].[2H]c1c([2H])c([2H])c2c(c1[2H])-c1c([2H])c([2H])c([2H])c(-c3c4c([2H])c([2H])c([2H])c([2H])c4c(-c4c([2H])c([2H])c5oc6c([2H])c7c([2H])c([2H])c([2H])c([2H])c7c([2H])c6c5c4[2H])c4c([2H])c([2H])c([2H])c([2H])c34)c1C2(C([2H])([2H])[2H])C([2H])([2H])[2H].
What is the InChIKey of 1,3,4,6,7,8,9,10,11-nonadeuterio-2-[1,2,3,4,5,6,7,8-octadeuterio-10-[2,3,4,5,6,7,8-heptadeuterio-9,9-bis(trideuteriomethyl)fluoren-1-yl]anthracen-9-yl]naphtho[2,3-b][1]benzofuran;1,3,4,6,7,8,9,10,11-nonadeuterio-2-[1,2,3,4,5,6,7,8-octadeuterio-10-(1,2,3,5,6,7,8-heptadeuterio-9,9-dimethylfluoren-4-yl)anthracen-9-yl]naphtho[2,3-b][1]benzofuran;1,3,4,6,7,8,9,10,11-nonadeuterio-2-[1,2,3,4,5,6,7,8-octadeuterio-10-(1,2,4,5,6,7,8-heptadeuterio-9,9-dimethylfluoren-3-yl)anthracen-9-yl]naphtho[2,3-b][1]benzofuran;1,3,4,6,7,8,9,10,11-nonadeuterio-2-[1,2,3,4,5,6,7,8-octadeuterio-10-[1,3,4,5,6,7,8-heptadeuterio-9-methyl-9-(trideuteriomethyl)fluoren-2-yl]anthracen-9-yl]naphtho[2,3-b][1]benzofuran?
The InChIKey is KMCJOJGSKCZTNE-NDIJJRPESA-N. The full InChI is InChI=1S/4C45H30O/c1-45(2)39-21-10-9-14-30(39)35-19-11-20-36(44(35)45)43-33-17-7-5-15-31(33)42(32-16-6-8-18-34(32)43)29-22-23-40-37(25-29)38-24-27-12-3-4-13-28(27)26-41(38)46-40;1-45(2)38-20-10-9-18-34(38)44-35(19-11-21-39(44)45)43-32-16-7-5-14-30(32)42(31-15-6-8-17-33(31)43)29-22-23-40-36(25-29)37-24-27-12-3-4-13-28(27)26-41(37)46-40;1-45(2)39-18-10-9-13-31(39)32-21-19-30(25-40(32)45)44-35-16-7-5-14-33(35)43(34-15-6-8-17-36(34)44)29-20-22-41-37(24-29)38-23-27-11-3-4-12-28(27)26-42(38)46-41;1-45(2)39-18-10-9-13-31(39)36-24-29(19-21-40(36)45)43-32-14-5-7-16-34(32)44(35-17-8-6-15-33(35)43)30-20-22-41-37(25-30)38-23-27-11-3-4-12-28(27)26-42(38)46-41/h4*3-26H,1-2H3/i1D3,2D3,3D,4D,5D,6D,7D,8D,9D,10D,11D,12D,13D,14D,15D,16D,17D,18D,19D,20D,21D,22D,23D,24D,25D,26D;3D,4D,5D,6D,7D,8D,9D,10D,11D,12D,13D,14D,15D,16D,17D,18D,19D,20D,21D,22D,23D,24D,25D,26D;1D3,3D,4D,5D,6D,7D,8D,9D,10D,11D,12D,13D,14D,15D,16D,17D,18D,19D,20D,21D,22D,23D,24D,25D,26D;3D,4D,5D,6D,7D,8D,9D,10D,11D,12D,13D,14D,15D,16D,17D,18D,19D,20D,21D,22D,23D,24D,25D,26D.
What are the key properties of 1,3,4,6,7,8,9,10,11-nonadeuterio-2-[1,2,3,4,5,6,7,8-octadeuterio-10-[2,3,4,5,6,7,8-heptadeuterio-9,9-bis(trideuteriomethyl)fluoren-1-yl]anthracen-9-yl]naphtho[2,3-b][1]benzofuran;1,3,4,6,7,8,9,10,11-nonadeuterio-2-[1,2,3,4,5,6,7,8-octadeuterio-10-(1,2,3,5,6,7,8-heptadeuterio-9,9-dimethylfluoren-4-yl)anthracen-9-yl]naphtho[2,3-b][1]benzofuran;1,3,4,6,7,8,9,10,11-nonadeuterio-2-[1,2,3,4,5,6,7,8-octadeuterio-10-(1,2,4,5,6,7,8-heptadeuterio-9,9-dimethylfluoren-3-yl)anthracen-9-yl]naphtho[2,3-b][1]benzofuran;1,3,4,6,7,8,9,10,11-nonadeuterio-2-[1,2,3,4,5,6,7,8-octadeuterio-10-[1,3,4,5,6,7,8-heptadeuterio-9-methyl-9-(trideuteriomethyl)fluoren-2-yl]anthracen-9-yl]naphtho[2,3-b][1]benzofuran?
1,3,4,6,7,8,9,10,11-nonadeuterio-2-[1,2,3,4,5,6,7,8-octadeuterio-10-[2,3,4,5,6,7,8-heptadeuterio-9,9-bis(trideuteriomethyl)fluoren-1-yl]anthracen-9-yl]naphtho[2,3-b][1]benzofuran;1,3,4,6,7,8,9,10,11-nonadeuterio-2-[1,2,3,4,5,6,7,8-octadeuterio-10-(1,2,3,5,6,7,8-heptadeuterio-9,9-dimethylfluoren-4-yl)anthracen-9-yl]naphtho[2,3-b][1]benzofuran;1,3,4,6,7,8,9,10,11-nonadeuterio-2-[1,2,3,4,5,6,7,8-octadeuterio-10-(1,2,4,5,6,7,8-heptadeuterio-9,9-dimethylfluoren-3-yl)anthracen-9-yl]naphtho[2,3-b][1]benzofuran;1,3,4,6,7,8,9,10,11-nonadeuterio-2-[1,2,3,4,5,6,7,8-octadeuterio-10-[1,3,4,5,6,7,8-heptadeuterio-9-methyl-9-(trideuteriomethyl)fluoren-2-yl]anthracen-9-yl]naphtho[2,3-b][1]benzofuran has a molecular weight of 2452.58 g/mol, XLogP of 50.74, 11 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1,3,4,6,7,8,9,10,11-nonadeuterio-2-[1,2,3,4,5,6,7,8-octadeuterio-10-[2,3,4,5,6,7,8-heptadeuterio-9,9-bis(trideuteriomethyl)fluoren-1-yl]anthracen-9-yl]naphtho[2,3-b][1]benzofuran;1,3,4,6,7,8,9,10,11-nonadeuterio-2-[1,2,3,4,5,6,7,8-octadeuterio-10-(1,2,3,5,6,7,8-heptadeuterio-9,9-dimethylfluoren-4-yl)anthracen-9-yl]naphtho[2,3-b][1]benzofuran;1,3,4,6,7,8,9,10,11-nonadeuterio-2-[1,2,3,4,5,6,7,8-octadeuterio-10-(1,2,4,5,6,7,8-heptadeuterio-9,9-dimethylfluoren-3-yl)anthracen-9-yl]naphtho[2,3-b][1]benzofuran;1,3,4,6,7,8,9,10,11-nonadeuterio-2-[1,2,3,4,5,6,7,8-octadeuterio-10-[1,3,4,5,6,7,8-heptadeuterio-9-methyl-9-(trideuteriomethyl)fluoren-2-yl]anthracen-9-yl]naphtho[2,3-b][1]benzofuran is sourced from PubChem (CID 159174482), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).