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

C244H150O5 — CID 160844269

IUPAC8-[4-(1,2,3,4,5,6,7,8-octadeuterio-10-phenanthren-2-ylanthracen-9-yl)phenyl]naphtho[1,2-b][1]benzofuran;8-[4-(1,2,3,4,5,6,7,8-octadeuterio-10-phenanthren-9-ylanthracen-9-yl)phenyl]naphtho[1,2-b][1]benzofuran;8-[4-[1,2,3,4,5,6,7,8-octadeuterio-10-(2-phenylphenyl)anthracen-9-yl]phenyl]naphtho[1,2-b][1]benzofuran;8-[4-[1,2,3,4,5,6,7,8-octadeuterio-10-(3-phenylphenyl)anthracen-9-yl]phenyl]naphtho[1,2-b][1]benzofuran;8-[4-[1,2,3,4,5,6,7,8-octadeuterio-10-(4-phenylphenyl)anthracen-9-yl]phenyl]naphtho[1,2-b][1]benzofuran
SMILES[2H]c1c([2H])c([2H])c2c(-c3cc4ccccc4c4ccccc34)c3c([2H])c([2H])c([2H])c([2H])c3c(-c3ccc(-c4ccc5oc6c7ccccc7ccc6c5c4)cc3)c2c1[2H].[2H]c1c([2H])c([2H])c2c(-c3ccc(-c4ccc5oc6c7ccccc7ccc6c5c4)cc3)c3c([2H])c([2H])c([2H])c([2H])c3c(-c3ccc(-c4ccccc4)cc3)c2c1[2H].[2H]c1c([2H])c([2H])c2c(-c3ccc4c(ccc5ccccc54)c3)c3c([2H])c([2H])c([2H])c([2H])c3c(-c3ccc(-c4ccc5oc6c7ccccc7ccc6c5c4)cc3)c2c1[2H].[2H]c1c([2H])c([2H])c2c(-c3cccc(-c4ccccc4)c3)c3c([2H])c([2H])c([2H])c([2H])c3c(-c3ccc(-c4ccc5oc6c7ccccc7ccc6c5c4)cc3)c2c1[2H].[2H]c1c([2H])c([2H])c2c(-c3ccccc3-c3ccccc3)c3c([2H])c([2H])c([2H])c([2H])c3c(-c3ccc(-c4ccc5oc6c7ccccc7ccc6c5c4)cc3)c2c1[2H]
InChIInChI=1S/2C50H30O.3C48H30O/c1-4-14-37-32(11-1)25-27-44-45-29-34(26-28-47(45)51-50(37)44)31-21-23-33(24-22-31)48-40-17-7-9-19-42(40)49(43-20-10-8-18-41(43)48)46-30-35-12-2-3-13-36(35)38-15-5-6-16-39(38)46;1-3-11-38-32(9-1)19-22-36-29-37(24-26-39(36)38)49-43-15-7-5-13-41(43)48(42-14-6-8-16-44(42)49)34-20-17-31(18-21-34)35-25-28-47-46(30-35)45-27-23-33-10-2-4-12-40(33)50(45)51-47;1-2-11-31(12-3-1)35-14-10-15-37(29-35)47-41-19-8-6-17-39(41)46(40-18-7-9-20-42(40)47)34-23-21-32(22-24-34)36-26-28-45-44(30-36)43-27-25-33-13-4-5-16-38(33)48(43)49-45;1-2-10-31(11-3-1)32-18-22-35(23-19-32)46-39-14-6-8-16-41(39)47(42-17-9-7-15-40(42)46)36-24-20-33(21-25-36)37-27-29-45-44(30-37)43-28-26-34-12-4-5-13-38(34)48(43)49-45;1-2-12-32(13-3-1)36-15-6-7-17-38(36)47-41-20-10-8-18-39(41)46(40-19-9-11-21-42(40)47)34-24-22-31(23-25-34)35-27-29-45-44(30-35)43-28-26-33-14-4-5-16-37(33)48(43)49-45/h2*1-30H;3*1-30H/i7D,8D,9D,10D,17D,18D,19D,20D;5D,6D,7D,8D,13D,14D,15D,16D;6D,7D,8D,9D,17D,18D,19D,20D;6D,7D,8D,9D,14D,15D,16D,17D;8D,9D,10D,11D,18D,19D,20D,21D
InChIKeySIKZIHMFXTZNCN-DWINJHDVSA-N
MW3202.12 g/mol
LogP69.85
Rot. Bonds18

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

8-[4-(1,2,3,4,5,6,7,8-octadeuterio-10-phenanthren-2-ylanthracen-9-yl)phenyl]naphtho[1,2-b][1]benzofuran;8-[4-(1,2,3,4,5,6,7,8-octadeuterio-10-phenanthren-9-ylanthracen-9-yl)phenyl]naphtho[1,2-b][1]benzofuran;8-[4-[1,2,3,4,5,6,7,8-octadeuterio-10-(2-phenylphenyl)anthracen-9-yl]phenyl]naphtho[1,2-b][1]benzofuran;8-[4-[1,2,3,4,5,6,7,8-octadeuterio-10-(3-phenylphenyl)anthracen-9-yl]phenyl]naphtho[1,2-b][1]benzofuran;8-[4-[1,2,3,4,5,6,7,8-octadeuterio-10-(4-phenylphenyl)anthracen-9-yl]phenyl]naphtho[1,2-b][1]benzofuran (PubChem CID 160844269) has the molecular formula C244H150O5 and a molecular weight of 3202.12 g/mol. Its IUPAC name is 8-[4-(1,2,3,4,5,6,7,8-octadeuterio-10-phenanthren-2-ylanthracen-9-yl)phenyl]naphtho[1,2-b][1]benzofuran;8-[4-(1,2,3,4,5,6,7,8-octadeuterio-10-phenanthren-9-ylanthracen-9-yl)phenyl]naphtho[1,2-b][1]benzofuran;8-[4-[1,2,3,4,5,6,7,8-octadeuterio-10-(2-phenylphenyl)anthracen-9-yl]phenyl]naphtho[1,2-b][1]benzofuran;8-[4-[1,2,3,4,5,6,7,8-octadeuterio-10-(3-phenylphenyl)anthracen-9-yl]phenyl]naphtho[1,2-b][1]benzofuran;8-[4-[1,2,3,4,5,6,7,8-octadeuterio-10-(4-phenylphenyl)anthracen-9-yl]phenyl]naphtho[1,2-b][1]benzofuran.

Molecular Properties

Compound Name8-[4-(1,2,3,4,5,6,7,8-octadeuterio-10-phenanthren-2-ylanthracen-9-yl)phenyl]naphtho[1,2-b][1]benzofuran;8-[4-(1,2,3,4,5,6,7,8-octadeuterio-10-phenanthren-9-ylanthracen-9-yl)phenyl]naphtho[1,2-b][1]benzofuran;8-[4-[1,2,3,4,5,6,7,8-octadeuterio-10-(2-phenylphenyl)anthracen-9-yl]phenyl]naphtho[1,2-b][1]benzofuran;8-[4-[1,2,3,4,5,6,7,8-octadeuterio-10-(3-phenylphenyl)anthracen-9-yl]phenyl]naphtho[1,2-b][1]benzofuran;8-[4-[1,2,3,4,5,6,7,8-octadeuterio-10-(4-phenylphenyl)anthracen-9-yl]phenyl]naphtho[1,2-b][1]benzofuran
PubChem CID160844269
Molecular FormulaC244H150O5
Molecular Weight3202.12 g/mol
Exact Mass3199.40
IUPAC Name8-[4-(1,2,3,4,5,6,7,8-octadeuterio-10-phenanthren-2-ylanthracen-9-yl)phenyl]naphtho[1,2-b][1]benzofuran;8-[4-(1,2,3,4,5,6,7,8-octadeuterio-10-phenanthren-9-ylanthracen-9-yl)phenyl]naphtho[1,2-b][1]benzofuran;8-[4-[1,2,3,4,5,6,7,8-octadeuterio-10-(2-phenylphenyl)anthracen-9-yl]phenyl]naphtho[1,2-b][1]benzofuran;8-[4-[1,2,3,4,5,6,7,8-octadeuterio-10-(3-phenylphenyl)anthracen-9-yl]phenyl]naphtho[1,2-b][1]benzofuran;8-[4-[1,2,3,4,5,6,7,8-octadeuterio-10-(4-phenylphenyl)anthracen-9-yl]phenyl]naphtho[1,2-b][1]benzofuran
SMILES[2H]c1c([2H])c([2H])c2c(-c3cc4ccccc4c4ccccc34)c3c([2H])c([2H])c([2H])c([2H])c3c(-c3ccc(-c4ccc5oc6c7ccccc7ccc6c5c4)cc3)c2c1[2H].[2H]c1c([2H])c([2H])c2c(-c3ccc(-c4ccc5oc6c7ccccc7ccc6c5c4)cc3)c3c([2H])c([2H])c([2H])c([2H])c3c(-c3ccc(-c4ccccc4)cc3)c2c1[2H].[2H]c1c([2H])c([2H])c2c(-c3ccc4c(ccc5ccccc54)c3)c3c([2H])c([2H])c([2H])c([2H])c3c(-c3ccc(-c4ccc5oc6c7ccccc7ccc6c5c4)cc3)c2c1[2H].[2H]c1c([2H])c([2H])c2c(-c3cccc(-c4ccccc4)c3)c3c([2H])c([2H])c([2H])c([2H])c3c(-c3ccc(-c4ccc5oc6c7ccccc7ccc6c5c4)cc3)c2c1[2H].[2H]c1c([2H])c([2H])c2c(-c3ccccc3-c3ccccc3)c3c([2H])c([2H])c([2H])c([2H])c3c(-c3ccc(-c4ccc5oc6c7ccccc7ccc6c5c4)cc3)c2c1[2H]
InChIInChI=1S/2C50H30O.3C48H30O/c1-4-14-37-32(11-1)25-27-44-45-29-34(26-28-47(45)51-50(37)44)31-21-23-33(24-22-31)48-40-17-7-9-19-42(40)49(43-20-10-8-18-41(43)48)46-30-35-12-2-3-13-36(35)38-15-5-6-16-39(38)46;1-3-11-38-32(9-1)19-22-36-29-37(24-26-39(36)38)49-43-15-7-5-13-41(43)48(42-14-6-8-16-44(42)49)34-20-17-31(18-21-34)35-25-28-47-46(30-35)45-27-23-33-10-2-4-12-40(33)50(45)51-47;1-2-11-31(12-3-1)35-14-10-15-37(29-35)47-41-19-8-6-17-39(41)46(40-18-7-9-20-42(40)47)34-23-21-32(22-24-34)36-26-28-45-44(30-36)43-27-25-33-13-4-5-16-38(33)48(43)49-45;1-2-10-31(11-3-1)32-18-22-35(23-19-32)46-39-14-6-8-16-41(39)47(42-17-9-7-15-40(42)46)36-24-20-33(21-25-36)37-27-29-45-44(30-37)43-28-26-34-12-4-5-13-38(34)48(43)49-45;1-2-12-32(13-3-1)36-15-6-7-17-38(36)47-41-20-10-8-18-39(41)46(40-19-9-11-21-42(40)47)34-24-22-31(23-25-34)35-27-29-45-44(30-35)43-28-26-33-14-4-5-16-37(33)48(43)49-45/h2*1-30H;3*1-30H/i7D,8D,9D,10D,17D,18D,19D,20D;5D,6D,7D,8D,13D,14D,15D,16D;6D,7D,8D,9D,17D,18D,19D,20D;6D,7D,8D,9D,14D,15D,16D,17D;8D,9D,10D,11D,18D,19D,20D,21D
InChIKeySIKZIHMFXTZNCN-DWINJHDVSA-N
XLogP69.85
TPSA65.70 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds18
Heavy Atoms249
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5003202.12
LogP ≤ 569.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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

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Related Compounds

8-[4-(1,2,3,4,5,6,7,8-octadeuterio-10-phenanthren-2-ylanthracen-9-yl)phenyl]naphtho[1,2-b][1]benzofuran
CID 153473773
2-[1,2,3,4,5,6,7,8-octadeuterio-10-(3,5-diphenylphenyl)anthracen-9-yl]dibenzofuran;2-[1,2,3,4,5,6,7,8-octadeuterio-10-(4-naphthalen-1-ylphenyl)anthracen-9-yl]dibenzofuran;2-[1,2,3,4,5,6,7,8-octadeuterio-10-(4-naphthalen-2-ylphenyl)anthracen-9-yl]dibenzofuran;2-[1,2,3,4,5,6,7,8-octadeuterio-10-(4-phenanthren-9-ylphenyl)anthracen-9-yl]dibenzofuran;2-[1,2,3,4,5,6,7,8-octadeuterio-10-[2-(4-phenylphenyl)phenyl]anthracen-9-yl]dibenzofuran;2-[1,2,3,4,5,6,7,8-octadeuterio-10-[4-(4-phenylphenyl)phenyl]anthracen-9-yl]dibenzofuran
CID 158967601
8-(1,2,3,4,5,6,7,8-octadeuterio-10-phenanthren-3-ylanthracen-9-yl)naphtho[1,2-b][1]benzofuran;8-(1,2,3,4,5,6,7,8-octadeuterio-10-phenanthren-4-ylanthracen-9-yl)naphtho[1,2-b][1]benzofuran;8-[1,2,3,4,5,6,7,8-octadeuterio-10-(3-phenanthren-1-ylphenyl)anthracen-9-yl]naphtho[1,2-b][1]benzofuran;8-[1,2,3,4,5,6,7,8-octadeuterio-10-(3-phenanthren-2-ylphenyl)anthracen-9-yl]naphtho[1,2-b][1]benzofuran;8-[1,2,3,4,5,6,7,8-octadeuterio-10-(3-phenanthren-3-ylphenyl)anthracen-9-yl]naphtho[1,2-b][1]benzofuran
CID 159262409
8-(1,2,3,4,5,6,7,8-octadeuterio-10-phenylanthracen-9-yl)naphtho[1,2-b][1]benzofuran
CID 153473731
8-(1,2,3,4,5,6,7,8-octadeuterio-10-naphthalen-1-ylanthracen-9-yl)naphtho[1,2-b][1]benzofuran
CID 153473930
8-[1,2,3,4,5,6,7,8-octadeuterio-10-(4-naphthalen-2-ylphenyl)anthracen-9-yl]naphtho[1,2-b][1]benzofuran
CID 153473799
8-[1,2,3,4,5,6,7,8-octadeuterio-10-(9,9-dimethylfluoren-1-yl)anthracen-9-yl]naphtho[1,2-b][1]benzofuran;8-[1,2,3,4,5,6,7,8-octadeuterio-10-(9,9-dimethylfluoren-2-yl)anthracen-9-yl]naphtho[1,2-b][1]benzofuran;8-(1,2,3,4,5,6,7,8-octadeuterio-10-phenanthren-9-ylanthracen-9-yl)naphtho[1,2-b][1]benzofuran;8-[1,2,3,4,5,6,7,8-octadeuterio-10-(7-phenylphenanthren-2-yl)anthracen-9-yl]naphtho[1,2-b][1]benzofuran
CID 159341841
8-(10-naphthalen-2-ylanthracen-9-yl)naphtho[1,2-b][1]benzofuran;8-[3-(10-naphthalen-1-ylanthracen-9-yl)phenyl]naphtho[1,2-b][1]benzofuran;8-(10-phenylanthracen-9-yl)naphtho[1,2-b][1]benzofuran;8-[10-(4-phenylphenyl)anthracen-9-yl]naphtho[1,2-b][1]benzofuran;8-[4-[10-(4-phenylphenyl)anthracen-9-yl]phenyl]naphtho[1,2-b][1]benzofuran
CID 158036336
8-[10-(2,3,4,5-tetradeuterio-6-phenylphenyl)anthracen-9-yl]naphtho[1,2-b][1]benzofuran
CID 170653484
7-[1,2,3,4,5,6,7,8-octadeuterio-10-(3,4-diphenylphenyl)anthracen-9-yl]naphtho[1,2-b][1]benzofuran;7-[1,2,3,4,5,6,7,8-octadeuterio-10-(3,5-diphenylphenyl)anthracen-9-yl]naphtho[1,2-b][1]benzofuran;7-(1,2,3,4,5,6,7,8-octadeuterio-10-naphthalen-2-ylanthracen-9-yl)naphtho[1,2-b][1]benzofuran;7-[1,2,3,4,5,6,7,8-octadeuterio-10-(4-naphthalen-1-ylphenyl)anthracen-9-yl]naphtho[1,2-b][1]benzofuran;7-[1,2,3,4,5,6,7,8-octadeuterio-10-(2-phenylphenyl)anthracen-9-yl]naphtho[1,2-b][1]benzofuran;7-[1,2,3,4,5,6,7,8-octadeuterio-10-(3-phenylphenyl)anthracen-9-yl]naphtho[1,2-b][1]benzofuran;7-[1,2,3,4,5,6,7,8-octadeuterio-10-(4-phenylphenyl)anthracen-9-yl]naphtho[1,2-b][1]benzofuran;7-[1,2,3,4,5,6,7,8-octadeuterio-10-[2-(4-phenylphenyl)phenyl]anthracen-9-yl]naphtho[1,2-b][1]benzofuran
CID 165052916
7-[1,2,3,4,5,6,7,8-octadeuterio-10-(4-phenanthren-9-ylphenyl)anthracen-9-yl]naphtho[1,2-b][1]benzofuran
CID 153473853
7-[1,2,3,4,5,6,7,8-octadeuterio-10-(6-phenylnaphthalen-2-yl)anthracen-9-yl]naphtho[1,2-b][1]benzofuran
CID 153473719

Frequently Asked Questions

What is the IUPAC name of 8-[4-(1,2,3,4,5,6,7,8-octadeuterio-10-phenanthren-2-ylanthracen-9-yl)phenyl]naphtho[1,2-b][1]benzofuran;8-[4-(1,2,3,4,5,6,7,8-octadeuterio-10-phenanthren-9-ylanthracen-9-yl)phenyl]naphtho[1,2-b][1]benzofuran;8-[4-[1,2,3,4,5,6,7,8-octadeuterio-10-(2-phenylphenyl)anthracen-9-yl]phenyl]naphtho[1,2-b][1]benzofuran;8-[4-[1,2,3,4,5,6,7,8-octadeuterio-10-(3-phenylphenyl)anthracen-9-yl]phenyl]naphtho[1,2-b][1]benzofuran;8-[4-[1,2,3,4,5,6,7,8-octadeuterio-10-(4-phenylphenyl)anthracen-9-yl]phenyl]naphtho[1,2-b][1]benzofuran?
The IUPAC name of 8-[4-(1,2,3,4,5,6,7,8-octadeuterio-10-phenanthren-2-ylanthracen-9-yl)phenyl]naphtho[1,2-b][1]benzofuran;8-[4-(1,2,3,4,5,6,7,8-octadeuterio-10-phenanthren-9-ylanthracen-9-yl)phenyl]naphtho[1,2-b][1]benzofuran;8-[4-[1,2,3,4,5,6,7,8-octadeuterio-10-(2-phenylphenyl)anthracen-9-yl]phenyl]naphtho[1,2-b][1]benzofuran;8-[4-[1,2,3,4,5,6,7,8-octadeuterio-10-(3-phenylphenyl)anthracen-9-yl]phenyl]naphtho[1,2-b][1]benzofuran;8-[4-[1,2,3,4,5,6,7,8-octadeuterio-10-(4-phenylphenyl)anthracen-9-yl]phenyl]naphtho[1,2-b][1]benzofuran (CID 160844269) is 8-[4-(1,2,3,4,5,6,7,8-octadeuterio-10-phenanthren-2-ylanthracen-9-yl)phenyl]naphtho[1,2-b][1]benzofuran;8-[4-(1,2,3,4,5,6,7,8-octadeuterio-10-phenanthren-9-ylanthracen-9-yl)phenyl]naphtho[1,2-b][1]benzofuran;8-[4-[1,2,3,4,5,6,7,8-octadeuterio-10-(2-phenylphenyl)anthracen-9-yl]phenyl]naphtho[1,2-b][1]benzofuran;8-[4-[1,2,3,4,5,6,7,8-octadeuterio-10-(3-phenylphenyl)anthracen-9-yl]phenyl]naphtho[1,2-b][1]benzofuran;8-[4-[1,2,3,4,5,6,7,8-octadeuterio-10-(4-phenylphenyl)anthracen-9-yl]phenyl]naphtho[1,2-b][1]benzofuran.
What is the SMILES notation for 8-[4-(1,2,3,4,5,6,7,8-octadeuterio-10-phenanthren-2-ylanthracen-9-yl)phenyl]naphtho[1,2-b][1]benzofuran;8-[4-(1,2,3,4,5,6,7,8-octadeuterio-10-phenanthren-9-ylanthracen-9-yl)phenyl]naphtho[1,2-b][1]benzofuran;8-[4-[1,2,3,4,5,6,7,8-octadeuterio-10-(2-phenylphenyl)anthracen-9-yl]phenyl]naphtho[1,2-b][1]benzofuran;8-[4-[1,2,3,4,5,6,7,8-octadeuterio-10-(3-phenylphenyl)anthracen-9-yl]phenyl]naphtho[1,2-b][1]benzofuran;8-[4-[1,2,3,4,5,6,7,8-octadeuterio-10-(4-phenylphenyl)anthracen-9-yl]phenyl]naphtho[1,2-b][1]benzofuran?
The canonical SMILES for 8-[4-(1,2,3,4,5,6,7,8-octadeuterio-10-phenanthren-2-ylanthracen-9-yl)phenyl]naphtho[1,2-b][1]benzofuran;8-[4-(1,2,3,4,5,6,7,8-octadeuterio-10-phenanthren-9-ylanthracen-9-yl)phenyl]naphtho[1,2-b][1]benzofuran;8-[4-[1,2,3,4,5,6,7,8-octadeuterio-10-(2-phenylphenyl)anthracen-9-yl]phenyl]naphtho[1,2-b][1]benzofuran;8-[4-[1,2,3,4,5,6,7,8-octadeuterio-10-(3-phenylphenyl)anthracen-9-yl]phenyl]naphtho[1,2-b][1]benzofuran;8-[4-[1,2,3,4,5,6,7,8-octadeuterio-10-(4-phenylphenyl)anthracen-9-yl]phenyl]naphtho[1,2-b][1]benzofuran is [2H]c1c([2H])c([2H])c2c(-c3cc4ccccc4c4ccccc34)c3c([2H])c([2H])c([2H])c([2H])c3c(-c3ccc(-c4ccc5oc6c7ccccc7ccc6c5c4)cc3)c2c1[2H].[2H]c1c([2H])c([2H])c2c(-c3ccc(-c4ccc5oc6c7ccccc7ccc6c5c4)cc3)c3c([2H])c([2H])c([2H])c([2H])c3c(-c3ccc(-c4ccccc4)cc3)c2c1[2H].[2H]c1c([2H])c([2H])c2c(-c3ccc4c(ccc5ccccc54)c3)c3c([2H])c([2H])c([2H])c([2H])c3c(-c3ccc(-c4ccc5oc6c7ccccc7ccc6c5c4)cc3)c2c1[2H].[2H]c1c([2H])c([2H])c2c(-c3cccc(-c4ccccc4)c3)c3c([2H])c([2H])c([2H])c([2H])c3c(-c3ccc(-c4ccc5oc6c7ccccc7ccc6c5c4)cc3)c2c1[2H].[2H]c1c([2H])c([2H])c2c(-c3ccccc3-c3ccccc3)c3c([2H])c([2H])c([2H])c([2H])c3c(-c3ccc(-c4ccc5oc6c7ccccc7ccc6c5c4)cc3)c2c1[2H].
What is the InChIKey of 8-[4-(1,2,3,4,5,6,7,8-octadeuterio-10-phenanthren-2-ylanthracen-9-yl)phenyl]naphtho[1,2-b][1]benzofuran;8-[4-(1,2,3,4,5,6,7,8-octadeuterio-10-phenanthren-9-ylanthracen-9-yl)phenyl]naphtho[1,2-b][1]benzofuran;8-[4-[1,2,3,4,5,6,7,8-octadeuterio-10-(2-phenylphenyl)anthracen-9-yl]phenyl]naphtho[1,2-b][1]benzofuran;8-[4-[1,2,3,4,5,6,7,8-octadeuterio-10-(3-phenylphenyl)anthracen-9-yl]phenyl]naphtho[1,2-b][1]benzofuran;8-[4-[1,2,3,4,5,6,7,8-octadeuterio-10-(4-phenylphenyl)anthracen-9-yl]phenyl]naphtho[1,2-b][1]benzofuran?
The InChIKey is SIKZIHMFXTZNCN-DWINJHDVSA-N. The full InChI is InChI=1S/2C50H30O.3C48H30O/c1-4-14-37-32(11-1)25-27-44-45-29-34(26-28-47(45)51-50(37)44)31-21-23-33(24-22-31)48-40-17-7-9-19-42(40)49(43-20-10-8-18-41(43)48)46-30-35-12-2-3-13-36(35)38-15-5-6-16-39(38)46;1-3-11-38-32(9-1)19-22-36-29-37(24-26-39(36)38)49-43-15-7-5-13-41(43)48(42-14-6-8-16-44(42)49)34-20-17-31(18-21-34)35-25-28-47-46(30-35)45-27-23-33-10-2-4-12-40(33)50(45)51-47;1-2-11-31(12-3-1)35-14-10-15-37(29-35)47-41-19-8-6-17-39(41)46(40-18-7-9-20-42(40)47)34-23-21-32(22-24-34)36-26-28-45-44(30-36)43-27-25-33-13-4-5-16-38(33)48(43)49-45;1-2-10-31(11-3-1)32-18-22-35(23-19-32)46-39-14-6-8-16-41(39)47(42-17-9-7-15-40(42)46)36-24-20-33(21-25-36)37-27-29-45-44(30-37)43-28-26-34-12-4-5-13-38(34)48(43)49-45;1-2-12-32(13-3-1)36-15-6-7-17-38(36)47-41-20-10-8-18-39(41)46(40-19-9-11-21-42(40)47)34-24-22-31(23-25-34)35-27-29-45-44(30-35)43-28-26-33-14-4-5-16-37(33)48(43)49-45/h2*1-30H;3*1-30H/i7D,8D,9D,10D,17D,18D,19D,20D;5D,6D,7D,8D,13D,14D,15D,16D;6D,7D,8D,9D,17D,18D,19D,20D;6D,7D,8D,9D,14D,15D,16D,17D;8D,9D,10D,11D,18D,19D,20D,21D.
What are the key properties of 8-[4-(1,2,3,4,5,6,7,8-octadeuterio-10-phenanthren-2-ylanthracen-9-yl)phenyl]naphtho[1,2-b][1]benzofuran;8-[4-(1,2,3,4,5,6,7,8-octadeuterio-10-phenanthren-9-ylanthracen-9-yl)phenyl]naphtho[1,2-b][1]benzofuran;8-[4-[1,2,3,4,5,6,7,8-octadeuterio-10-(2-phenylphenyl)anthracen-9-yl]phenyl]naphtho[1,2-b][1]benzofuran;8-[4-[1,2,3,4,5,6,7,8-octadeuterio-10-(3-phenylphenyl)anthracen-9-yl]phenyl]naphtho[1,2-b][1]benzofuran;8-[4-[1,2,3,4,5,6,7,8-octadeuterio-10-(4-phenylphenyl)anthracen-9-yl]phenyl]naphtho[1,2-b][1]benzofuran?
8-[4-(1,2,3,4,5,6,7,8-octadeuterio-10-phenanthren-2-ylanthracen-9-yl)phenyl]naphtho[1,2-b][1]benzofuran;8-[4-(1,2,3,4,5,6,7,8-octadeuterio-10-phenanthren-9-ylanthracen-9-yl)phenyl]naphtho[1,2-b][1]benzofuran;8-[4-[1,2,3,4,5,6,7,8-octadeuterio-10-(2-phenylphenyl)anthracen-9-yl]phenyl]naphtho[1,2-b][1]benzofuran;8-[4-[1,2,3,4,5,6,7,8-octadeuterio-10-(3-phenylphenyl)anthracen-9-yl]phenyl]naphtho[1,2-b][1]benzofuran;8-[4-[1,2,3,4,5,6,7,8-octadeuterio-10-(4-phenylphenyl)anthracen-9-yl]phenyl]naphtho[1,2-b][1]benzofuran has a molecular weight of 3202.12 g/mol, XLogP of 69.85, 18 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 8-[4-(1,2,3,4,5,6,7,8-octadeuterio-10-phenanthren-2-ylanthracen-9-yl)phenyl]naphtho[1,2-b][1]benzofuran;8-[4-(1,2,3,4,5,6,7,8-octadeuterio-10-phenanthren-9-ylanthracen-9-yl)phenyl]naphtho[1,2-b][1]benzofuran;8-[4-[1,2,3,4,5,6,7,8-octadeuterio-10-(2-phenylphenyl)anthracen-9-yl]phenyl]naphtho[1,2-b][1]benzofuran;8-[4-[1,2,3,4,5,6,7,8-octadeuterio-10-(3-phenylphenyl)anthracen-9-yl]phenyl]naphtho[1,2-b][1]benzofuran;8-[4-[1,2,3,4,5,6,7,8-octadeuterio-10-(4-phenylphenyl)anthracen-9-yl]phenyl]naphtho[1,2-b][1]benzofuran is sourced from PubChem (CID 160844269), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).