2-[4-[bis(4-phenylphenyl)methyl]phenyl]naphthalene

C41H30 — CID 155790042

IUPAC2-[4-[bis(4-phenylphenyl)methyl]phenyl]naphthalene
SMILESc1ccc(-c2ccc(C(c3ccc(-c4ccccc4)cc3)c3ccc(-c4ccc5ccccc5c4)cc3)cc2)cc1
InChIInChI=1S/C41H30/c1-3-9-30(10-4-1)33-15-22-36(23-16-33)41(37-24-17-34(18-25-37)31-11-5-2-6-12-31)38-26-19-35(20-27-38)40-28-21-32-13-7-8-14-39(32)29-40/h1-29,41H
InChIKeyZLGSHFNCZMKRKV-UHFFFAOYSA-N
MW522.69 g/mol
LogP11.02
Rot. Bonds6

About 2-[4-[bis(4-phenylphenyl)methyl]phenyl]naphthalene

2-[4-[bis(4-phenylphenyl)methyl]phenyl]naphthalene (PubChem CID 155790042) has the molecular formula C41H30 and a molecular weight of 522.69 g/mol. Its IUPAC name is 2-[4-[bis(4-phenylphenyl)methyl]phenyl]naphthalene.

Molecular Properties

Compound Name2-[4-[bis(4-phenylphenyl)methyl]phenyl]naphthalene
PubChem CID155790042
Molecular FormulaC41H30
Molecular Weight522.69 g/mol
Exact Mass522.23
IUPAC Name2-[4-[bis(4-phenylphenyl)methyl]phenyl]naphthalene
SMILESc1ccc(-c2ccc(C(c3ccc(-c4ccccc4)cc3)c3ccc(-c4ccc5ccccc5c4)cc3)cc2)cc1
InChIInChI=1S/C41H30/c1-3-9-30(10-4-1)33-15-22-36(23-16-33)41(37-24-17-34(18-25-37)31-11-5-2-6-12-31)38-26-19-35(20-27-38)40-28-21-32-13-7-8-14-39(32)29-40/h1-29,41H
InChIKeyZLGSHFNCZMKRKV-UHFFFAOYSA-N
XLogP11.02
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds6
Heavy Atoms41
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500522.69
LogP ≤ 511.02
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'triphenyl_methyl-silyl', 'substructure': 'N/A'}

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Related Compounds

benzo[f]azulene
CID 13065869
(4-naphthalen-2-ylphenyl)-phenylmethanamine
CID 142482108
2-(4-naphthalen-2-ylphenyl)-7-[7-(4-phenylphenyl)phenanthren-2-yl]phenanthrene
CID 59629194
2-naphthalen-2-yl-6-(3-naphthalen-2-yl-5-phenylphenyl)anthracene
CID 143886275
2,7-diphenylanthracene
CID 154020316
2,4-bis(4-naphthalen-2-ylphenyl)-6-(4-phenylphenyl)-1,3,5-triazine
CID 153292216
3-(6-naphthalen-2-ylnaphthalen-2-yl)-9-phenylchrysene
CID 123868192
2-(4-naphthalen-2-ylphenyl)-4-phenyl-6-(6-phenylnaphthalen-2-yl)-1,3,5-triazine
CID 170180018
2-naphthalen-2-yl-4-(7-naphthalen-2-ylnaphthalen-2-yl)-6-(6-phenylnaphthalen-2-yl)-1,3,5-triazine
CID 176588187
2-[3-(4-methylphenyl)-5-(4-phenylphenyl)phenyl]naphthalene
CID 156673302
9,10-dinaphthalen-2-ylanthracene;9-naphthalen-2-yl-10-(6-phenylnaphthalen-2-yl)anthracene
CID 143848431
1-[bis(4-methoxyphenyl)methyl]-4-phenylbenzene
CID 134976312

Frequently Asked Questions

What is the IUPAC name of 2-[4-[bis(4-phenylphenyl)methyl]phenyl]naphthalene?
The IUPAC name of 2-[4-[bis(4-phenylphenyl)methyl]phenyl]naphthalene (CID 155790042) is 2-[4-[bis(4-phenylphenyl)methyl]phenyl]naphthalene.
What is the SMILES notation for 2-[4-[bis(4-phenylphenyl)methyl]phenyl]naphthalene?
The canonical SMILES for 2-[4-[bis(4-phenylphenyl)methyl]phenyl]naphthalene is c1ccc(-c2ccc(C(c3ccc(-c4ccccc4)cc3)c3ccc(-c4ccc5ccccc5c4)cc3)cc2)cc1.
What is the InChIKey of 2-[4-[bis(4-phenylphenyl)methyl]phenyl]naphthalene?
The InChIKey is ZLGSHFNCZMKRKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C41H30/c1-3-9-30(10-4-1)33-15-22-36(23-16-33)41(37-24-17-34(18-25-37)31-11-5-2-6-12-31)38-26-19-35(20-27-38)40-28-21-32-13-7-8-14-39(32)29-40/h1-29,41H.
What are the key properties of 2-[4-[bis(4-phenylphenyl)methyl]phenyl]naphthalene?
2-[4-[bis(4-phenylphenyl)methyl]phenyl]naphthalene has a molecular weight of 522.69 g/mol, XLogP of 11.02, 6 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-[bis(4-phenylphenyl)methyl]phenyl]naphthalene is sourced from PubChem (CID 155790042), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).