(3-methylphenyl)-[2-(trifluoromethyl)phenyl]methanone

C15H11F3O — CID 55120964

IUPAC(3-methylphenyl)-[2-(trifluoromethyl)phenyl]methanone
SMILESCc1cccc(C(=O)c2ccccc2C(F)(F)F)c1
InChIInChI=1S/C15H11F3O/c1-10-5-4-6-11(9-10)14(19)12-7-2-3-8-13(12)15(16,17)18/h2-9H,1H3
InChIKeyARVIGKGPGXIAQJ-UHFFFAOYSA-N
MW264.25 g/mol
LogP4.24
Rot. Bonds2

About (3-methylphenyl)-[2-(trifluoromethyl)phenyl]methanone

(3-methylphenyl)-[2-(trifluoromethyl)phenyl]methanone (PubChem CID 55120964) has the molecular formula C15H11F3O and a molecular weight of 264.25 g/mol. Its IUPAC name is (3-methylphenyl)-[2-(trifluoromethyl)phenyl]methanone.

Molecular Properties

Compound Name(3-methylphenyl)-[2-(trifluoromethyl)phenyl]methanone
PubChem CID55120964
Molecular FormulaC15H11F3O
Molecular Weight264.25 g/mol
Exact Mass264.08
IUPAC Name(3-methylphenyl)-[2-(trifluoromethyl)phenyl]methanone
SMILESCc1cccc(C(=O)c2ccccc2C(F)(F)F)c1
InChIInChI=1S/C15H11F3O/c1-10-5-4-6-11(9-10)14(19)12-7-2-3-8-13(12)15(16,17)18/h2-9H,1H3
InChIKeyARVIGKGPGXIAQJ-UHFFFAOYSA-N
XLogP4.24
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.25
LogP ≤ 54.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

(3-chlorophenyl)-[2-(trifluoromethyl)phenyl]methanone
CID 62802145
[3-[2-(trifluoromethyl)benzoyl]phenyl] acetate
CID 24722930
(3-ethoxyphenyl)-[2-(trifluoromethyl)phenyl]methanone
CID 62801807
(4-bromo-3,5-dimethylphenyl)-[2-(trifluoromethyl)phenyl]methanone
CID 114329543
2-(3-methylbenzoyl)benzoic acid
CID 2801746
(3-methylphenyl)-[3-(trifluoromethyl)phenyl]methanone
CID 55026756
2-[(3-methylbenzoyl)amino]-N-[2-(trifluoromethyl)phenyl]benzamide
CID 9172409
bis(3-methylphenyl)methanone
CID 17848
(3,4-dichlorophenyl)-[2-(trifluoromethyl)phenyl]methanone
CID 43344485
N-(3-methylphenyl)-2-(trifluoromethyl)benzamide
CID 846758
(2,3-difluorophenyl)-(3-methylphenyl)methanone
CID 63987550
(3,5-dibromophenyl)-[2-(trifluoromethyl)phenyl]methanone
CID 107976795

Frequently Asked Questions

What is the IUPAC name of (3-methylphenyl)-[2-(trifluoromethyl)phenyl]methanone?
The IUPAC name of (3-methylphenyl)-[2-(trifluoromethyl)phenyl]methanone (CID 55120964) is (3-methylphenyl)-[2-(trifluoromethyl)phenyl]methanone.
What is the SMILES notation for (3-methylphenyl)-[2-(trifluoromethyl)phenyl]methanone?
The canonical SMILES for (3-methylphenyl)-[2-(trifluoromethyl)phenyl]methanone is Cc1cccc(C(=O)c2ccccc2C(F)(F)F)c1.
What is the InChIKey of (3-methylphenyl)-[2-(trifluoromethyl)phenyl]methanone?
The InChIKey is ARVIGKGPGXIAQJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11F3O/c1-10-5-4-6-11(9-10)14(19)12-7-2-3-8-13(12)15(16,17)18/h2-9H,1H3.
What are the key properties of (3-methylphenyl)-[2-(trifluoromethyl)phenyl]methanone?
(3-methylphenyl)-[2-(trifluoromethyl)phenyl]methanone has a molecular weight of 264.25 g/mol, XLogP of 4.24, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (3-methylphenyl)-[2-(trifluoromethyl)phenyl]methanone is sourced from PubChem (CID 55120964), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).