1,2,3,4,5,6,8,9,11-nonadeuterio-10-[1,2,3,4,5,6,7,8-octadeuterio-10-(9,9-dimethylfluoren-2-yl)anthracen-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-(9,9-dimethylfluoren-3-yl)anthracen-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-(9,9-dimethylfluoren-4-yl)anthracen-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-phenanthren-2-ylanthracen-9-yl)naphtho[2,1-b][1]benzofuran;10-[3-(1,2,3,4,5,6,7,8-octadeuterio-10-phenylanthracen-9-yl)phenyl]naphtho[2,1-b][1]benzofuran

C221H142O5 — CID 160771989

IUPAC1,2,3,4,5,6,8,9,11-nonadeuterio-10-[1,2,3,4,5,6,7,8-octadeuterio-10-(9,9-dimethylfluoren-2-yl)anthracen-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-(9,9-dimethylfluoren-3-yl)anthracen-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-(9,9-dimethylfluoren-4-yl)anthracen-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-phenanthren-2-ylanthracen-9-yl)naphtho[2,1-b][1]benzofuran;10-[3-(1,2,3,4,5,6,7,8-octadeuterio-10-phenylanthracen-9-yl)phenyl]naphtho[2,1-b][1]benzofuran
SMILES[2H]c1c(-c2c3c([2H])c([2H])c([2H])c([2H])c3c(-c3ccc4c(c3)-c3ccccc3C4(C)C)c3c([2H])c([2H])c([2H])c([2H])c23)c([2H])c2c(oc3c([2H])c([2H])c4c([2H])c([2H])c([2H])c([2H])c4c32)c1[2H].[2H]c1c(-c2c3c([2H])c([2H])c([2H])c([2H])c3c(-c3ccc4c(c3)C(C)(C)c3ccccc3-4)c3c([2H])c([2H])c([2H])c([2H])c23)c([2H])c2c(oc3c([2H])c([2H])c4c([2H])c([2H])c([2H])c([2H])c4c32)c1[2H].[2H]c1c(-c2c3c([2H])c([2H])c([2H])c([2H])c3c(-c3ccc4c(ccc5ccccc54)c3)c3c([2H])c([2H])c([2H])c([2H])c23)c([2H])c2c(oc3c([2H])c([2H])c4c([2H])c([2H])c([2H])c([2H])c4c32)c1[2H].[2H]c1c(-c2c3c([2H])c([2H])c([2H])c([2H])c3c(-c3cccc4c3-c3ccccc3C4(C)C)c3c([2H])c([2H])c([2H])c([2H])c23)c([2H])c2c(oc3c([2H])c([2H])c4c([2H])c([2H])c([2H])c([2H])c4c32)c1[2H].[2H]c1c([2H])c([2H])c2c(-c3cccc(-c4ccc5oc6ccc7ccccc7c6c5c4)c3)c3c([2H])c([2H])c([2H])c([2H])c3c(-c3ccccc3)c2c1[2H]
InChIInChI=1S/3C45H30O.C44H26O.C42H26O/c1-45(2)37-20-10-9-18-34(37)43-35(19-11-21-38(43)45)42-32-16-7-5-14-30(32)41(31-15-6-8-17-33(31)42)28-23-24-39-36(26-28)44-29-13-4-3-12-27(29)22-25-40(44)46-39;1-45(2)38-18-10-9-13-31(38)32-22-19-29(26-39(32)45)43-35-16-7-5-14-33(35)42(34-15-6-8-17-36(34)43)28-21-23-40-37(25-28)44-30-12-4-3-11-27(30)20-24-41(44)46-40;1-45(2)38-18-10-9-13-31(38)36-25-28(19-22-39(36)45)42-32-14-5-7-16-34(32)43(35-17-8-6-15-33(35)42)29-21-23-40-37(26-29)44-30-12-4-3-11-27(30)20-24-41(44)46-40;1-3-11-32-27(9-1)17-18-29-25-30(19-22-33(29)32)42-35-13-5-7-15-37(35)43(38-16-8-6-14-36(38)42)31-21-23-40-39(26-31)44-34-12-4-2-10-28(34)20-24-41(44)45-40;1-2-12-28(13-3-1)40-33-17-6-8-19-35(33)41(36-20-9-7-18-34(36)40)31-15-10-14-29(25-31)30-22-23-38-37(26-30)42-32-16-5-4-11-27(32)21-24-39(42)43-38/h3*3-26H,1-2H3;1-26H;1-26H/i3D,4D,5D,6D,7D,8D,12D,13D,14D,15D,16D,17D,22D,23D,24D,25D,26D;3D,4D,5D,6D,7D,8D,11D,12D,14D,15D,16D,17D,20D,21D,23D,24D,25D;3D,4D,5D,6D,7D,8D,11D,12D,14D,15D,16D,17D,20D,21D,23D,24D,26D;2D,4D,5D,6D,7D,8D,10D,12D,13D,14D,15D,16D,20D,21D,23D,24D,26D;6D,7D,8D,9D,17D,18D,19D,20D
InChIKeyRZLBYUYLPGZLOB-MJXNKLAVSA-N
MW2954.03 g/mol
LogP62.79
Rot. Bonds11

About 1,2,3,4,5,6,8,9,11-nonadeuterio-10-[1,2,3,4,5,6,7,8-octadeuterio-10-(9,9-dimethylfluoren-2-yl)anthracen-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-(9,9-dimethylfluoren-3-yl)anthracen-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-(9,9-dimethylfluoren-4-yl)anthracen-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-phenanthren-2-ylanthracen-9-yl)naphtho[2,1-b][1]benzofuran;10-[3-(1,2,3,4,5,6,7,8-octadeuterio-10-phenylanthracen-9-yl)phenyl]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-(9,9-dimethylfluoren-2-yl)anthracen-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-(9,9-dimethylfluoren-3-yl)anthracen-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-(9,9-dimethylfluoren-4-yl)anthracen-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-phenanthren-2-ylanthracen-9-yl)naphtho[2,1-b][1]benzofuran;10-[3-(1,2,3,4,5,6,7,8-octadeuterio-10-phenylanthracen-9-yl)phenyl]naphtho[2,1-b][1]benzofuran (PubChem CID 160771989) has the molecular formula C221H142O5 and a molecular weight of 2954.03 g/mol. Its IUPAC name is 1,2,3,4,5,6,8,9,11-nonadeuterio-10-[1,2,3,4,5,6,7,8-octadeuterio-10-(9,9-dimethylfluoren-2-yl)anthracen-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-(9,9-dimethylfluoren-3-yl)anthracen-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-(9,9-dimethylfluoren-4-yl)anthracen-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-phenanthren-2-ylanthracen-9-yl)naphtho[2,1-b][1]benzofuran;10-[3-(1,2,3,4,5,6,7,8-octadeuterio-10-phenylanthracen-9-yl)phenyl]naphtho[2,1-b][1]benzofuran.

Molecular Properties

Compound Name1,2,3,4,5,6,8,9,11-nonadeuterio-10-[1,2,3,4,5,6,7,8-octadeuterio-10-(9,9-dimethylfluoren-2-yl)anthracen-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-(9,9-dimethylfluoren-3-yl)anthracen-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-(9,9-dimethylfluoren-4-yl)anthracen-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-phenanthren-2-ylanthracen-9-yl)naphtho[2,1-b][1]benzofuran;10-[3-(1,2,3,4,5,6,7,8-octadeuterio-10-phenylanthracen-9-yl)phenyl]naphtho[2,1-b][1]benzofuran
PubChem CID160771989
Molecular FormulaC221H142O5
Molecular Weight2954.03 g/mol
Exact Mass2951.56
IUPAC Name1,2,3,4,5,6,8,9,11-nonadeuterio-10-[1,2,3,4,5,6,7,8-octadeuterio-10-(9,9-dimethylfluoren-2-yl)anthracen-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-(9,9-dimethylfluoren-3-yl)anthracen-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-(9,9-dimethylfluoren-4-yl)anthracen-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-phenanthren-2-ylanthracen-9-yl)naphtho[2,1-b][1]benzofuran;10-[3-(1,2,3,4,5,6,7,8-octadeuterio-10-phenylanthracen-9-yl)phenyl]naphtho[2,1-b][1]benzofuran
SMILES[2H]c1c(-c2c3c([2H])c([2H])c([2H])c([2H])c3c(-c3ccc4c(c3)-c3ccccc3C4(C)C)c3c([2H])c([2H])c([2H])c([2H])c23)c([2H])c2c(oc3c([2H])c([2H])c4c([2H])c([2H])c([2H])c([2H])c4c32)c1[2H].[2H]c1c(-c2c3c([2H])c([2H])c([2H])c([2H])c3c(-c3ccc4c(c3)C(C)(C)c3ccccc3-4)c3c([2H])c([2H])c([2H])c([2H])c23)c([2H])c2c(oc3c([2H])c([2H])c4c([2H])c([2H])c([2H])c([2H])c4c32)c1[2H].[2H]c1c(-c2c3c([2H])c([2H])c([2H])c([2H])c3c(-c3ccc4c(ccc5ccccc54)c3)c3c([2H])c([2H])c([2H])c([2H])c23)c([2H])c2c(oc3c([2H])c([2H])c4c([2H])c([2H])c([2H])c([2H])c4c32)c1[2H].[2H]c1c(-c2c3c([2H])c([2H])c([2H])c([2H])c3c(-c3cccc4c3-c3ccccc3C4(C)C)c3c([2H])c([2H])c([2H])c([2H])c23)c([2H])c2c(oc3c([2H])c([2H])c4c([2H])c([2H])c([2H])c([2H])c4c32)c1[2H].[2H]c1c([2H])c([2H])c2c(-c3cccc(-c4ccc5oc6ccc7ccccc7c6c5c4)c3)c3c([2H])c([2H])c([2H])c([2H])c3c(-c3ccccc3)c2c1[2H]
InChIInChI=1S/3C45H30O.C44H26O.C42H26O/c1-45(2)37-20-10-9-18-34(37)43-35(19-11-21-38(43)45)42-32-16-7-5-14-30(32)41(31-15-6-8-17-33(31)42)28-23-24-39-36(26-28)44-29-13-4-3-12-27(29)22-25-40(44)46-39;1-45(2)38-18-10-9-13-31(38)32-22-19-29(26-39(32)45)43-35-16-7-5-14-33(35)42(34-15-6-8-17-36(34)43)28-21-23-40-37(25-28)44-30-12-4-3-11-27(30)20-24-41(44)46-40;1-45(2)38-18-10-9-13-31(38)36-25-28(19-22-39(36)45)42-32-14-5-7-16-34(32)43(35-17-8-6-15-33(35)42)29-21-23-40-37(26-29)44-30-12-4-3-11-27(30)20-24-41(44)46-40;1-3-11-32-27(9-1)17-18-29-25-30(19-22-33(29)32)42-35-13-5-7-15-37(35)43(38-16-8-6-14-36(38)42)31-21-23-40-39(26-31)44-34-12-4-2-10-28(34)20-24-41(44)45-40;1-2-12-28(13-3-1)40-33-17-6-8-19-35(33)41(36-20-9-7-18-34(36)40)31-15-10-14-29(25-31)30-22-23-38-37(26-30)42-32-16-5-4-11-27(32)21-24-39(42)43-38/h3*3-26H,1-2H3;1-26H;1-26H/i3D,4D,5D,6D,7D,8D,12D,13D,14D,15D,16D,17D,22D,23D,24D,25D,26D;3D,4D,5D,6D,7D,8D,11D,12D,14D,15D,16D,17D,20D,21D,23D,24D,25D;3D,4D,5D,6D,7D,8D,11D,12D,14D,15D,16D,17D,20D,21D,23D,24D,26D;2D,4D,5D,6D,7D,8D,10D,12D,13D,14D,15D,16D,20D,21D,23D,24D,26D;6D,7D,8D,9D,17D,18D,19D,20D
InChIKeyRZLBYUYLPGZLOB-MJXNKLAVSA-N
XLogP62.79
TPSA65.70 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds11
Heavy Atoms226
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5002954.03
LogP ≤ 562.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 1,2,3,4,5,6,8,9,11-nonadeuterio-10-[1,2,3,4,5,6,7,8-octadeuterio-10-(9,9-dimethylfluoren-2-yl)anthracen-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-(9,9-dimethylfluoren-3-yl)anthracen-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-(9,9-dimethylfluoren-4-yl)anthracen-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-phenanthren-2-ylanthracen-9-yl)naphtho[2,1-b][1]benzofuran;10-[3-(1,2,3,4,5,6,7,8-octadeuterio-10-phenylanthracen-9-yl)phenyl]naphtho[2,1-b][1]benzofuran with MolForge

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Frequently Asked Questions

What is the IUPAC name of 1,2,3,4,5,6,8,9,11-nonadeuterio-10-[1,2,3,4,5,6,7,8-octadeuterio-10-(9,9-dimethylfluoren-2-yl)anthracen-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-(9,9-dimethylfluoren-3-yl)anthracen-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-(9,9-dimethylfluoren-4-yl)anthracen-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-phenanthren-2-ylanthracen-9-yl)naphtho[2,1-b][1]benzofuran;10-[3-(1,2,3,4,5,6,7,8-octadeuterio-10-phenylanthracen-9-yl)phenyl]naphtho[2,1-b][1]benzofuran?
The IUPAC name of 1,2,3,4,5,6,8,9,11-nonadeuterio-10-[1,2,3,4,5,6,7,8-octadeuterio-10-(9,9-dimethylfluoren-2-yl)anthracen-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-(9,9-dimethylfluoren-3-yl)anthracen-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-(9,9-dimethylfluoren-4-yl)anthracen-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-phenanthren-2-ylanthracen-9-yl)naphtho[2,1-b][1]benzofuran;10-[3-(1,2,3,4,5,6,7,8-octadeuterio-10-phenylanthracen-9-yl)phenyl]naphtho[2,1-b][1]benzofuran (CID 160771989) is 1,2,3,4,5,6,8,9,11-nonadeuterio-10-[1,2,3,4,5,6,7,8-octadeuterio-10-(9,9-dimethylfluoren-2-yl)anthracen-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-(9,9-dimethylfluoren-3-yl)anthracen-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-(9,9-dimethylfluoren-4-yl)anthracen-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-phenanthren-2-ylanthracen-9-yl)naphtho[2,1-b][1]benzofuran;10-[3-(1,2,3,4,5,6,7,8-octadeuterio-10-phenylanthracen-9-yl)phenyl]naphtho[2,1-b][1]benzofuran.
What is the SMILES notation for 1,2,3,4,5,6,8,9,11-nonadeuterio-10-[1,2,3,4,5,6,7,8-octadeuterio-10-(9,9-dimethylfluoren-2-yl)anthracen-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-(9,9-dimethylfluoren-3-yl)anthracen-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-(9,9-dimethylfluoren-4-yl)anthracen-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-phenanthren-2-ylanthracen-9-yl)naphtho[2,1-b][1]benzofuran;10-[3-(1,2,3,4,5,6,7,8-octadeuterio-10-phenylanthracen-9-yl)phenyl]naphtho[2,1-b][1]benzofuran?
The canonical SMILES for 1,2,3,4,5,6,8,9,11-nonadeuterio-10-[1,2,3,4,5,6,7,8-octadeuterio-10-(9,9-dimethylfluoren-2-yl)anthracen-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-(9,9-dimethylfluoren-3-yl)anthracen-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-(9,9-dimethylfluoren-4-yl)anthracen-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-phenanthren-2-ylanthracen-9-yl)naphtho[2,1-b][1]benzofuran;10-[3-(1,2,3,4,5,6,7,8-octadeuterio-10-phenylanthracen-9-yl)phenyl]naphtho[2,1-b][1]benzofuran is [2H]c1c(-c2c3c([2H])c([2H])c([2H])c([2H])c3c(-c3ccc4c(c3)-c3ccccc3C4(C)C)c3c([2H])c([2H])c([2H])c([2H])c23)c([2H])c2c(oc3c([2H])c([2H])c4c([2H])c([2H])c([2H])c([2H])c4c32)c1[2H].[2H]c1c(-c2c3c([2H])c([2H])c([2H])c([2H])c3c(-c3ccc4c(c3)C(C)(C)c3ccccc3-4)c3c([2H])c([2H])c([2H])c([2H])c23)c([2H])c2c(oc3c([2H])c([2H])c4c([2H])c([2H])c([2H])c([2H])c4c32)c1[2H].[2H]c1c(-c2c3c([2H])c([2H])c([2H])c([2H])c3c(-c3ccc4c(ccc5ccccc54)c3)c3c([2H])c([2H])c([2H])c([2H])c23)c([2H])c2c(oc3c([2H])c([2H])c4c([2H])c([2H])c([2H])c([2H])c4c32)c1[2H].[2H]c1c(-c2c3c([2H])c([2H])c([2H])c([2H])c3c(-c3cccc4c3-c3ccccc3C4(C)C)c3c([2H])c([2H])c([2H])c([2H])c23)c([2H])c2c(oc3c([2H])c([2H])c4c([2H])c([2H])c([2H])c([2H])c4c32)c1[2H].[2H]c1c([2H])c([2H])c2c(-c3cccc(-c4ccc5oc6ccc7ccccc7c6c5c4)c3)c3c([2H])c([2H])c([2H])c([2H])c3c(-c3ccccc3)c2c1[2H].
What is the InChIKey of 1,2,3,4,5,6,8,9,11-nonadeuterio-10-[1,2,3,4,5,6,7,8-octadeuterio-10-(9,9-dimethylfluoren-2-yl)anthracen-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-(9,9-dimethylfluoren-3-yl)anthracen-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-(9,9-dimethylfluoren-4-yl)anthracen-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-phenanthren-2-ylanthracen-9-yl)naphtho[2,1-b][1]benzofuran;10-[3-(1,2,3,4,5,6,7,8-octadeuterio-10-phenylanthracen-9-yl)phenyl]naphtho[2,1-b][1]benzofuran?
The InChIKey is RZLBYUYLPGZLOB-MJXNKLAVSA-N. The full InChI is InChI=1S/3C45H30O.C44H26O.C42H26O/c1-45(2)37-20-10-9-18-34(37)43-35(19-11-21-38(43)45)42-32-16-7-5-14-30(32)41(31-15-6-8-17-33(31)42)28-23-24-39-36(26-28)44-29-13-4-3-12-27(29)22-25-40(44)46-39;1-45(2)38-18-10-9-13-31(38)32-22-19-29(26-39(32)45)43-35-16-7-5-14-33(35)42(34-15-6-8-17-36(34)43)28-21-23-40-37(25-28)44-30-12-4-3-11-27(30)20-24-41(44)46-40;1-45(2)38-18-10-9-13-31(38)36-25-28(19-22-39(36)45)42-32-14-5-7-16-34(32)43(35-17-8-6-15-33(35)42)29-21-23-40-37(26-29)44-30-12-4-3-11-27(30)20-24-41(44)46-40;1-3-11-32-27(9-1)17-18-29-25-30(19-22-33(29)32)42-35-13-5-7-15-37(35)43(38-16-8-6-14-36(38)42)31-21-23-40-39(26-31)44-34-12-4-2-10-28(34)20-24-41(44)45-40;1-2-12-28(13-3-1)40-33-17-6-8-19-35(33)41(36-20-9-7-18-34(36)40)31-15-10-14-29(25-31)30-22-23-38-37(26-30)42-32-16-5-4-11-27(32)21-24-39(42)43-38/h3*3-26H,1-2H3;1-26H;1-26H/i3D,4D,5D,6D,7D,8D,12D,13D,14D,15D,16D,17D,22D,23D,24D,25D,26D;3D,4D,5D,6D,7D,8D,11D,12D,14D,15D,16D,17D,20D,21D,23D,24D,25D;3D,4D,5D,6D,7D,8D,11D,12D,14D,15D,16D,17D,20D,21D,23D,24D,26D;2D,4D,5D,6D,7D,8D,10D,12D,13D,14D,15D,16D,20D,21D,23D,24D,26D;6D,7D,8D,9D,17D,18D,19D,20D.
What are the key properties of 1,2,3,4,5,6,8,9,11-nonadeuterio-10-[1,2,3,4,5,6,7,8-octadeuterio-10-(9,9-dimethylfluoren-2-yl)anthracen-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-(9,9-dimethylfluoren-3-yl)anthracen-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-(9,9-dimethylfluoren-4-yl)anthracen-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-phenanthren-2-ylanthracen-9-yl)naphtho[2,1-b][1]benzofuran;10-[3-(1,2,3,4,5,6,7,8-octadeuterio-10-phenylanthracen-9-yl)phenyl]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-(9,9-dimethylfluoren-2-yl)anthracen-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-(9,9-dimethylfluoren-3-yl)anthracen-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-(9,9-dimethylfluoren-4-yl)anthracen-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-phenanthren-2-ylanthracen-9-yl)naphtho[2,1-b][1]benzofuran;10-[3-(1,2,3,4,5,6,7,8-octadeuterio-10-phenylanthracen-9-yl)phenyl]naphtho[2,1-b][1]benzofuran has a molecular weight of 2954.03 g/mol, XLogP of 62.79, 11 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2,3,4,5,6,8,9,11-nonadeuterio-10-[1,2,3,4,5,6,7,8-octadeuterio-10-(9,9-dimethylfluoren-2-yl)anthracen-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-(9,9-dimethylfluoren-3-yl)anthracen-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-(9,9-dimethylfluoren-4-yl)anthracen-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-phenanthren-2-ylanthracen-9-yl)naphtho[2,1-b][1]benzofuran;10-[3-(1,2,3,4,5,6,7,8-octadeuterio-10-phenylanthracen-9-yl)phenyl]naphtho[2,1-b][1]benzofuran is sourced from PubChem (CID 160771989), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).