2-[2-methyl-6-phenyl-3-(trifluoromethyl)phenyl]naphthalene

C24H17F3 — CID 140969950

IUPAC2-[2-methyl-6-phenyl-3-(trifluoromethyl)phenyl]naphthalene
SMILESCc1c(C(F)(F)F)ccc(-c2ccccc2)c1-c1ccc2ccccc2c1
InChIInChI=1S/C24H17F3/c1-16-22(24(25,26)27)14-13-21(18-8-3-2-4-9-18)23(16)20-12-11-17-7-5-6-10-19(17)15-20/h2-15H,1H3
InChIKeyQXJHBINDSHMKKI-UHFFFAOYSA-N
MW362.39 g/mol
LogP7.50
Rot. Bonds2

About 2-[2-methyl-6-phenyl-3-(trifluoromethyl)phenyl]naphthalene

2-[2-methyl-6-phenyl-3-(trifluoromethyl)phenyl]naphthalene (PubChem CID 140969950) has the molecular formula C24H17F3 and a molecular weight of 362.39 g/mol. Its IUPAC name is 2-[2-methyl-6-phenyl-3-(trifluoromethyl)phenyl]naphthalene.

Molecular Properties

Compound Name2-[2-methyl-6-phenyl-3-(trifluoromethyl)phenyl]naphthalene
PubChem CID140969950
Molecular FormulaC24H17F3
Molecular Weight362.39 g/mol
Exact Mass362.13
IUPAC Name2-[2-methyl-6-phenyl-3-(trifluoromethyl)phenyl]naphthalene
SMILESCc1c(C(F)(F)F)ccc(-c2ccccc2)c1-c1ccc2ccccc2c1
InChIInChI=1S/C24H17F3/c1-16-22(24(25,26)27)14-13-21(18-8-3-2-4-9-18)23(16)20-12-11-17-7-5-6-10-19(17)15-20/h2-15H,1H3
InChIKeyQXJHBINDSHMKKI-UHFFFAOYSA-N
XLogP7.50
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500362.39
LogP ≤ 57.50
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

4-methyl-2-phenyl-1-(trifluoromethyl)benzene
CID 46315075
9-[4-(2,6-diphenylphenyl)phenyl]-10-naphthalen-2-ylanthracene
CID 58965768
2-(2,3,5,6-tetramethylphenyl)naphthalene
CID 90733282
9-naphthalen-2-yl-10-(2-naphthalen-2-yl-6-phenylphenyl)anthracene
CID 171447256
9-[3-(1-naphthalen-2-ylnaphthalen-2-yl)phenyl]-10-[4-(2-phenylnaphthalen-1-yl)phenyl]anthracene
CID 59413105
ethane;9-naphthalen-2-yl-10-phenylanthracene
CID 91207825
2-(3,4,5-triphenylphenyl)naphthalene
CID 54408952
9-naphthalen-2-yl-10-[4-[4-[4-(10-naphthalen-2-ylanthracen-9-yl)phenyl]naphthalen-1-yl]phenyl]anthracene
CID 59523734
8-naphthalen-2-yl-5-(2-phenylnaphthalen-1-yl)benzo[c]phenanthrene
CID 59282131
9-naphthalen-2-yl-10-phenyl-2-(4-phenylnaphthalen-1-yl)anthracene
CID 162702349
9-naphthalen-2-yl-10-[4-(10-phenylanthracen-9-yl)phenyl]anthracene
CID 58876197
[2,4-bis(3-methylphenyl)-3-naphthalen-2-ylphenyl]methanol
CID 70018173

Frequently Asked Questions

What is the IUPAC name of 2-[2-methyl-6-phenyl-3-(trifluoromethyl)phenyl]naphthalene?
The IUPAC name of 2-[2-methyl-6-phenyl-3-(trifluoromethyl)phenyl]naphthalene (CID 140969950) is 2-[2-methyl-6-phenyl-3-(trifluoromethyl)phenyl]naphthalene.
What is the SMILES notation for 2-[2-methyl-6-phenyl-3-(trifluoromethyl)phenyl]naphthalene?
The canonical SMILES for 2-[2-methyl-6-phenyl-3-(trifluoromethyl)phenyl]naphthalene is Cc1c(C(F)(F)F)ccc(-c2ccccc2)c1-c1ccc2ccccc2c1.
What is the InChIKey of 2-[2-methyl-6-phenyl-3-(trifluoromethyl)phenyl]naphthalene?
The InChIKey is QXJHBINDSHMKKI-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H17F3/c1-16-22(24(25,26)27)14-13-21(18-8-3-2-4-9-18)23(16)20-12-11-17-7-5-6-10-19(17)15-20/h2-15H,1H3.
What are the key properties of 2-[2-methyl-6-phenyl-3-(trifluoromethyl)phenyl]naphthalene?
2-[2-methyl-6-phenyl-3-(trifluoromethyl)phenyl]naphthalene has a molecular weight of 362.39 g/mol, XLogP of 7.50, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-methyl-6-phenyl-3-(trifluoromethyl)phenyl]naphthalene is sourced from PubChem (CID 140969950), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).