2,7-bis(3-phenylnaphthalen-2-yl)phenanthrene;2,9-diphenyl-7-(3-phenylnaphthalen-2-yl)phenanthrene;2-(3,4-diphenylphenyl)-7-(3-phenylnaphthalen-2-yl)phenanthrene;2-(4-methylphenyl)-9-phenyl-7-(3-phenylnaphthalen-2-yl)phenanthrene;2-naphthalen-1-yl-9-phenyl-7-(3-phenylnaphthalen-2-yl)phenanthrene;2-naphthalen-2-yl-9-phenyl-7-(3-phenylnaphthalen-2-yl)phenanthrene

C271H180 — CID 162038318

IUPAC2,7-bis(3-phenylnaphthalen-2-yl)phenanthrene;2,9-diphenyl-7-(3-phenylnaphthalen-2-yl)phenanthrene;2-(3,4-diphenylphenyl)-7-(3-phenylnaphthalen-2-yl)phenanthrene;2-(4-methylphenyl)-9-phenyl-7-(3-phenylnaphthalen-2-yl)phenanthrene;2-naphthalen-1-yl-9-phenyl-7-(3-phenylnaphthalen-2-yl)phenanthrene;2-naphthalen-2-yl-9-phenyl-7-(3-phenylnaphthalen-2-yl)phenanthrene
SMILESCc1ccc(-c2ccc3c(c2)cc(-c2ccccc2)c2cc(-c4cc5ccccc5cc4-c4ccccc4)ccc23)cc1.c1ccc(-c2cc3ccccc3cc2-c2ccc3c(c2)c(-c2ccccc2)cc2cc(-c4ccc5ccccc5c4)ccc23)cc1.c1ccc(-c2cc3ccccc3cc2-c2ccc3c(c2)c(-c2ccccc2)cc2cc(-c4cccc5ccccc45)ccc23)cc1.c1ccc(-c2cc3ccccc3cc2-c2ccc3c(ccc4cc(-c5cc6ccccc6cc5-c5ccccc5)ccc43)c2)cc1.c1ccc(-c2ccc(-c3ccc4c(ccc5cc(-c6cc7ccccc7cc6-c6ccccc6)ccc54)c3)cc2-c2ccccc2)cc1.c1ccc(-c2ccc3c(c2)cc(-c2ccccc2)c2cc(-c4cc5ccccc5cc4-c4ccccc4)ccc23)cc1
InChIInChI=1S/C48H32.3C46H30.C43H30.C42H28/c1-4-12-33(13-5-1)43-25-23-39(32-46(43)34-14-6-2-7-15-34)38-22-26-44-40(28-38)20-21-41-29-42(24-27-45(41)44)48-31-37-19-11-10-18-36(37)30-47(48)35-16-8-3-9-17-35;1-3-11-31(12-4-1)43-27-33-15-7-9-17-35(33)29-45(43)39-21-23-41-37(25-39)19-20-38-26-40(22-24-42(38)41)46-30-36-18-10-8-16-34(36)28-44(46)32-13-5-2-6-14-32;1-3-12-32(13-4-1)43-27-34-17-7-8-18-35(34)28-45(43)37-23-25-42-41-24-22-36(40-21-11-19-31-16-9-10-20-39(31)40)26-38(41)30-44(46(42)29-37)33-14-5-2-6-15-33;1-3-12-32(13-4-1)43-27-35-17-9-10-18-36(35)28-45(43)39-22-24-42-41-23-21-38(37-20-19-31-11-7-8-16-34(31)25-37)26-40(41)30-44(46(42)29-39)33-14-5-2-6-15-33;1-29-16-18-30(19-17-29)35-20-22-38-37(24-35)28-41(32-12-6-3-7-13-32)43-27-36(21-23-39(38)43)42-26-34-15-9-8-14-33(34)25-40(42)31-10-4-2-5-11-31;1-4-12-29(13-5-1)34-20-22-37-36(24-34)28-40(31-16-8-3-9-17-31)42-27-35(21-23-38(37)42)41-26-33-19-11-10-18-32(33)25-39(41)30-14-6-2-7-15-30/h1-32H;3*1-30H;2-28H,1H3;1-28H
InChIKeyYWYBGEROZLSEPH-UHFFFAOYSA-N
MW3436.42 g/mol
LogP76.32
Rot. Bonds25

About 2,7-bis(3-phenylnaphthalen-2-yl)phenanthrene;2,9-diphenyl-7-(3-phenylnaphthalen-2-yl)phenanthrene;2-(3,4-diphenylphenyl)-7-(3-phenylnaphthalen-2-yl)phenanthrene;2-(4-methylphenyl)-9-phenyl-7-(3-phenylnaphthalen-2-yl)phenanthrene;2-naphthalen-1-yl-9-phenyl-7-(3-phenylnaphthalen-2-yl)phenanthrene;2-naphthalen-2-yl-9-phenyl-7-(3-phenylnaphthalen-2-yl)phenanthrene

2,7-bis(3-phenylnaphthalen-2-yl)phenanthrene;2,9-diphenyl-7-(3-phenylnaphthalen-2-yl)phenanthrene;2-(3,4-diphenylphenyl)-7-(3-phenylnaphthalen-2-yl)phenanthrene;2-(4-methylphenyl)-9-phenyl-7-(3-phenylnaphthalen-2-yl)phenanthrene;2-naphthalen-1-yl-9-phenyl-7-(3-phenylnaphthalen-2-yl)phenanthrene;2-naphthalen-2-yl-9-phenyl-7-(3-phenylnaphthalen-2-yl)phenanthrene (PubChem CID 162038318) has the molecular formula C271H180 and a molecular weight of 3436.42 g/mol. Its IUPAC name is 2,7-bis(3-phenylnaphthalen-2-yl)phenanthrene;2,9-diphenyl-7-(3-phenylnaphthalen-2-yl)phenanthrene;2-(3,4-diphenylphenyl)-7-(3-phenylnaphthalen-2-yl)phenanthrene;2-(4-methylphenyl)-9-phenyl-7-(3-phenylnaphthalen-2-yl)phenanthrene;2-naphthalen-1-yl-9-phenyl-7-(3-phenylnaphthalen-2-yl)phenanthrene;2-naphthalen-2-yl-9-phenyl-7-(3-phenylnaphthalen-2-yl)phenanthrene.

Molecular Properties

Compound Name2,7-bis(3-phenylnaphthalen-2-yl)phenanthrene;2,9-diphenyl-7-(3-phenylnaphthalen-2-yl)phenanthrene;2-(3,4-diphenylphenyl)-7-(3-phenylnaphthalen-2-yl)phenanthrene;2-(4-methylphenyl)-9-phenyl-7-(3-phenylnaphthalen-2-yl)phenanthrene;2-naphthalen-1-yl-9-phenyl-7-(3-phenylnaphthalen-2-yl)phenanthrene;2-naphthalen-2-yl-9-phenyl-7-(3-phenylnaphthalen-2-yl)phenanthrene
PubChem CID162038318
Molecular FormulaC271H180
Molecular Weight3436.42 g/mol
Exact Mass3433.41
IUPAC Name2,7-bis(3-phenylnaphthalen-2-yl)phenanthrene;2,9-diphenyl-7-(3-phenylnaphthalen-2-yl)phenanthrene;2-(3,4-diphenylphenyl)-7-(3-phenylnaphthalen-2-yl)phenanthrene;2-(4-methylphenyl)-9-phenyl-7-(3-phenylnaphthalen-2-yl)phenanthrene;2-naphthalen-1-yl-9-phenyl-7-(3-phenylnaphthalen-2-yl)phenanthrene;2-naphthalen-2-yl-9-phenyl-7-(3-phenylnaphthalen-2-yl)phenanthrene
SMILESCc1ccc(-c2ccc3c(c2)cc(-c2ccccc2)c2cc(-c4cc5ccccc5cc4-c4ccccc4)ccc23)cc1.c1ccc(-c2cc3ccccc3cc2-c2ccc3c(c2)c(-c2ccccc2)cc2cc(-c4ccc5ccccc5c4)ccc23)cc1.c1ccc(-c2cc3ccccc3cc2-c2ccc3c(c2)c(-c2ccccc2)cc2cc(-c4cccc5ccccc45)ccc23)cc1.c1ccc(-c2cc3ccccc3cc2-c2ccc3c(ccc4cc(-c5cc6ccccc6cc5-c5ccccc5)ccc43)c2)cc1.c1ccc(-c2ccc(-c3ccc4c(ccc5cc(-c6cc7ccccc7cc6-c6ccccc6)ccc54)c3)cc2-c2ccccc2)cc1.c1ccc(-c2ccc3c(c2)cc(-c2ccccc2)c2cc(-c4cc5ccccc5cc4-c4ccccc4)ccc23)cc1
InChIInChI=1S/C48H32.3C46H30.C43H30.C42H28/c1-4-12-33(13-5-1)43-25-23-39(32-46(43)34-14-6-2-7-15-34)38-22-26-44-40(28-38)20-21-41-29-42(24-27-45(41)44)48-31-37-19-11-10-18-36(37)30-47(48)35-16-8-3-9-17-35;1-3-11-31(12-4-1)43-27-33-15-7-9-17-35(33)29-45(43)39-21-23-41-37(25-39)19-20-38-26-40(22-24-42(38)41)46-30-36-18-10-8-16-34(36)28-44(46)32-13-5-2-6-14-32;1-3-12-32(13-4-1)43-27-34-17-7-8-18-35(34)28-45(43)37-23-25-42-41-24-22-36(40-21-11-19-31-16-9-10-20-39(31)40)26-38(41)30-44(46(42)29-37)33-14-5-2-6-15-33;1-3-12-32(13-4-1)43-27-35-17-9-10-18-36(35)28-45(43)39-22-24-42-41-23-21-38(37-20-19-31-11-7-8-16-34(31)25-37)26-40(41)30-44(46(42)29-39)33-14-5-2-6-15-33;1-29-16-18-30(19-17-29)35-20-22-38-37(24-35)28-41(32-12-6-3-7-13-32)43-27-36(21-23-39(38)43)42-26-34-15-9-8-14-33(34)25-40(42)31-10-4-2-5-11-31;1-4-12-29(13-5-1)34-20-22-37-36(24-34)28-40(31-16-8-3-9-17-31)42-27-35(21-23-38(37)42)41-26-33-19-11-10-18-32(33)25-39(41)30-14-6-2-7-15-30/h1-32H;3*1-30H;2-28H,1H3;1-28H
InChIKeyYWYBGEROZLSEPH-UHFFFAOYSA-N
XLogP76.32
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds25
Heavy Atoms271
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5003436.42
LogP ≤ 576.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'}

Analyze 2,7-bis(3-phenylnaphthalen-2-yl)phenanthrene;2,9-diphenyl-7-(3-phenylnaphthalen-2-yl)phenanthrene;2-(3,4-diphenylphenyl)-7-(3-phenylnaphthalen-2-yl)phenanthrene;2-(4-methylphenyl)-9-phenyl-7-(3-phenylnaphthalen-2-yl)phenanthrene;2-naphthalen-1-yl-9-phenyl-7-(3-phenylnaphthalen-2-yl)phenanthrene;2-naphthalen-2-yl-9-phenyl-7-(3-phenylnaphthalen-2-yl)phenanthrene with MolForge

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Frequently Asked Questions

What is the IUPAC name of 2,7-bis(3-phenylnaphthalen-2-yl)phenanthrene;2,9-diphenyl-7-(3-phenylnaphthalen-2-yl)phenanthrene;2-(3,4-diphenylphenyl)-7-(3-phenylnaphthalen-2-yl)phenanthrene;2-(4-methylphenyl)-9-phenyl-7-(3-phenylnaphthalen-2-yl)phenanthrene;2-naphthalen-1-yl-9-phenyl-7-(3-phenylnaphthalen-2-yl)phenanthrene;2-naphthalen-2-yl-9-phenyl-7-(3-phenylnaphthalen-2-yl)phenanthrene?
The IUPAC name of 2,7-bis(3-phenylnaphthalen-2-yl)phenanthrene;2,9-diphenyl-7-(3-phenylnaphthalen-2-yl)phenanthrene;2-(3,4-diphenylphenyl)-7-(3-phenylnaphthalen-2-yl)phenanthrene;2-(4-methylphenyl)-9-phenyl-7-(3-phenylnaphthalen-2-yl)phenanthrene;2-naphthalen-1-yl-9-phenyl-7-(3-phenylnaphthalen-2-yl)phenanthrene;2-naphthalen-2-yl-9-phenyl-7-(3-phenylnaphthalen-2-yl)phenanthrene (CID 162038318) is 2,7-bis(3-phenylnaphthalen-2-yl)phenanthrene;2,9-diphenyl-7-(3-phenylnaphthalen-2-yl)phenanthrene;2-(3,4-diphenylphenyl)-7-(3-phenylnaphthalen-2-yl)phenanthrene;2-(4-methylphenyl)-9-phenyl-7-(3-phenylnaphthalen-2-yl)phenanthrene;2-naphthalen-1-yl-9-phenyl-7-(3-phenylnaphthalen-2-yl)phenanthrene;2-naphthalen-2-yl-9-phenyl-7-(3-phenylnaphthalen-2-yl)phenanthrene.
What is the SMILES notation for 2,7-bis(3-phenylnaphthalen-2-yl)phenanthrene;2,9-diphenyl-7-(3-phenylnaphthalen-2-yl)phenanthrene;2-(3,4-diphenylphenyl)-7-(3-phenylnaphthalen-2-yl)phenanthrene;2-(4-methylphenyl)-9-phenyl-7-(3-phenylnaphthalen-2-yl)phenanthrene;2-naphthalen-1-yl-9-phenyl-7-(3-phenylnaphthalen-2-yl)phenanthrene;2-naphthalen-2-yl-9-phenyl-7-(3-phenylnaphthalen-2-yl)phenanthrene?
The canonical SMILES for 2,7-bis(3-phenylnaphthalen-2-yl)phenanthrene;2,9-diphenyl-7-(3-phenylnaphthalen-2-yl)phenanthrene;2-(3,4-diphenylphenyl)-7-(3-phenylnaphthalen-2-yl)phenanthrene;2-(4-methylphenyl)-9-phenyl-7-(3-phenylnaphthalen-2-yl)phenanthrene;2-naphthalen-1-yl-9-phenyl-7-(3-phenylnaphthalen-2-yl)phenanthrene;2-naphthalen-2-yl-9-phenyl-7-(3-phenylnaphthalen-2-yl)phenanthrene is Cc1ccc(-c2ccc3c(c2)cc(-c2ccccc2)c2cc(-c4cc5ccccc5cc4-c4ccccc4)ccc23)cc1.c1ccc(-c2cc3ccccc3cc2-c2ccc3c(c2)c(-c2ccccc2)cc2cc(-c4ccc5ccccc5c4)ccc23)cc1.c1ccc(-c2cc3ccccc3cc2-c2ccc3c(c2)c(-c2ccccc2)cc2cc(-c4cccc5ccccc45)ccc23)cc1.c1ccc(-c2cc3ccccc3cc2-c2ccc3c(ccc4cc(-c5cc6ccccc6cc5-c5ccccc5)ccc43)c2)cc1.c1ccc(-c2ccc(-c3ccc4c(ccc5cc(-c6cc7ccccc7cc6-c6ccccc6)ccc54)c3)cc2-c2ccccc2)cc1.c1ccc(-c2ccc3c(c2)cc(-c2ccccc2)c2cc(-c4cc5ccccc5cc4-c4ccccc4)ccc23)cc1.
What is the InChIKey of 2,7-bis(3-phenylnaphthalen-2-yl)phenanthrene;2,9-diphenyl-7-(3-phenylnaphthalen-2-yl)phenanthrene;2-(3,4-diphenylphenyl)-7-(3-phenylnaphthalen-2-yl)phenanthrene;2-(4-methylphenyl)-9-phenyl-7-(3-phenylnaphthalen-2-yl)phenanthrene;2-naphthalen-1-yl-9-phenyl-7-(3-phenylnaphthalen-2-yl)phenanthrene;2-naphthalen-2-yl-9-phenyl-7-(3-phenylnaphthalen-2-yl)phenanthrene?
The InChIKey is YWYBGEROZLSEPH-UHFFFAOYSA-N. The full InChI is InChI=1S/C48H32.3C46H30.C43H30.C42H28/c1-4-12-33(13-5-1)43-25-23-39(32-46(43)34-14-6-2-7-15-34)38-22-26-44-40(28-38)20-21-41-29-42(24-27-45(41)44)48-31-37-19-11-10-18-36(37)30-47(48)35-16-8-3-9-17-35;1-3-11-31(12-4-1)43-27-33-15-7-9-17-35(33)29-45(43)39-21-23-41-37(25-39)19-20-38-26-40(22-24-42(38)41)46-30-36-18-10-8-16-34(36)28-44(46)32-13-5-2-6-14-32;1-3-12-32(13-4-1)43-27-34-17-7-8-18-35(34)28-45(43)37-23-25-42-41-24-22-36(40-21-11-19-31-16-9-10-20-39(31)40)26-38(41)30-44(46(42)29-37)33-14-5-2-6-15-33;1-3-12-32(13-4-1)43-27-35-17-9-10-18-36(35)28-45(43)39-22-24-42-41-23-21-38(37-20-19-31-11-7-8-16-34(31)25-37)26-40(41)30-44(46(42)29-39)33-14-5-2-6-15-33;1-29-16-18-30(19-17-29)35-20-22-38-37(24-35)28-41(32-12-6-3-7-13-32)43-27-36(21-23-39(38)43)42-26-34-15-9-8-14-33(34)25-40(42)31-10-4-2-5-11-31;1-4-12-29(13-5-1)34-20-22-37-36(24-34)28-40(31-16-8-3-9-17-31)42-27-35(21-23-38(37)42)41-26-33-19-11-10-18-32(33)25-39(41)30-14-6-2-7-15-30/h1-32H;3*1-30H;2-28H,1H3;1-28H.
What are the key properties of 2,7-bis(3-phenylnaphthalen-2-yl)phenanthrene;2,9-diphenyl-7-(3-phenylnaphthalen-2-yl)phenanthrene;2-(3,4-diphenylphenyl)-7-(3-phenylnaphthalen-2-yl)phenanthrene;2-(4-methylphenyl)-9-phenyl-7-(3-phenylnaphthalen-2-yl)phenanthrene;2-naphthalen-1-yl-9-phenyl-7-(3-phenylnaphthalen-2-yl)phenanthrene;2-naphthalen-2-yl-9-phenyl-7-(3-phenylnaphthalen-2-yl)phenanthrene?
2,7-bis(3-phenylnaphthalen-2-yl)phenanthrene;2,9-diphenyl-7-(3-phenylnaphthalen-2-yl)phenanthrene;2-(3,4-diphenylphenyl)-7-(3-phenylnaphthalen-2-yl)phenanthrene;2-(4-methylphenyl)-9-phenyl-7-(3-phenylnaphthalen-2-yl)phenanthrene;2-naphthalen-1-yl-9-phenyl-7-(3-phenylnaphthalen-2-yl)phenanthrene;2-naphthalen-2-yl-9-phenyl-7-(3-phenylnaphthalen-2-yl)phenanthrene has a molecular weight of 3436.42 g/mol, XLogP of 76.32, 25 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2,7-bis(3-phenylnaphthalen-2-yl)phenanthrene;2,9-diphenyl-7-(3-phenylnaphthalen-2-yl)phenanthrene;2-(3,4-diphenylphenyl)-7-(3-phenylnaphthalen-2-yl)phenanthrene;2-(4-methylphenyl)-9-phenyl-7-(3-phenylnaphthalen-2-yl)phenanthrene;2-naphthalen-1-yl-9-phenyl-7-(3-phenylnaphthalen-2-yl)phenanthrene;2-naphthalen-2-yl-9-phenyl-7-(3-phenylnaphthalen-2-yl)phenanthrene is sourced from PubChem (CID 162038318), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).