(2-chlorophenyl)-(2-fluoro-4-methylphenyl)methanone

C14H10ClFO — CID 114963346

IUPAC(2-chlorophenyl)-(2-fluoro-4-methylphenyl)methanone
SMILESCc1ccc(C(=O)c2ccccc2Cl)c(F)c1
InChIInChI=1S/C14H10ClFO/c1-9-6-7-11(13(16)8-9)14(17)10-4-2-3-5-12(10)15/h2-8H,1H3
InChIKeyPJITYCRGNIAGIN-UHFFFAOYSA-N
MW248.68 g/mol
LogP4.02
Rot. Bonds2

About (2-chlorophenyl)-(2-fluoro-4-methylphenyl)methanone

(2-chlorophenyl)-(2-fluoro-4-methylphenyl)methanone (PubChem CID 114963346) has the molecular formula C14H10ClFO and a molecular weight of 248.68 g/mol. Its IUPAC name is (2-chlorophenyl)-(2-fluoro-4-methylphenyl)methanone.

Molecular Properties

Compound Name(2-chlorophenyl)-(2-fluoro-4-methylphenyl)methanone
PubChem CID114963346
Molecular FormulaC14H10ClFO
Molecular Weight248.68 g/mol
Exact Mass248.04
IUPAC Name(2-chlorophenyl)-(2-fluoro-4-methylphenyl)methanone
SMILESCc1ccc(C(=O)c2ccccc2Cl)c(F)c1
InChIInChI=1S/C14H10ClFO/c1-9-6-7-11(13(16)8-9)14(17)10-4-2-3-5-12(10)15/h2-8H,1H3
InChIKeyPJITYCRGNIAGIN-UHFFFAOYSA-N
XLogP4.02
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.68
LogP ≤ 54.02
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

(2-amino-5-methylphenyl)-(4-chloro-2-fluorophenyl)methanone
CID 116581480
(4-chloro-2-fluorophenyl)-(2,4-dimethylphenyl)methanone
CID 43160123
(3-chloro-2-fluorophenyl)-(2,5-dimethylphenyl)methanone
CID 64713968
(3-chloro-2-fluorophenyl)-(2,4-dimethylphenyl)methanone
CID 64712749
(2-chloro-4-fluorophenyl)-(2,5-dimethylphenyl)methanone
CID 43159718
(2-chloro-4,5-difluorophenyl)-(2-fluoro-5-methylphenyl)methanone
CID 107475658
(2-fluoro-4-methylphenyl)-(2-methylthiophen-3-yl)methanone
CID 102839725
(4-bromo-2-chlorophenyl)-(2-fluorophenyl)methanone
CID 114965969
(2-fluoro-4-methylphenyl)-isoquinolin-4-ylmethanone
CID 114971945
2-(2-chlorophenyl)-1-(2-fluoro-5-methylphenyl)ethanone
CID 62516230
(2-chlorophenyl)-(4-fluoro-3,5-dimethylphenyl)methanone
CID 65299171
(2-chlorophenyl)-(4-hydroxy-2-methylphenyl)methanone
CID 86254780

Frequently Asked Questions

What is the IUPAC name of (2-chlorophenyl)-(2-fluoro-4-methylphenyl)methanone?
The IUPAC name of (2-chlorophenyl)-(2-fluoro-4-methylphenyl)methanone (CID 114963346) is (2-chlorophenyl)-(2-fluoro-4-methylphenyl)methanone.
What is the SMILES notation for (2-chlorophenyl)-(2-fluoro-4-methylphenyl)methanone?
The canonical SMILES for (2-chlorophenyl)-(2-fluoro-4-methylphenyl)methanone is Cc1ccc(C(=O)c2ccccc2Cl)c(F)c1.
What is the InChIKey of (2-chlorophenyl)-(2-fluoro-4-methylphenyl)methanone?
The InChIKey is PJITYCRGNIAGIN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10ClFO/c1-9-6-7-11(13(16)8-9)14(17)10-4-2-3-5-12(10)15/h2-8H,1H3.
What are the key properties of (2-chlorophenyl)-(2-fluoro-4-methylphenyl)methanone?
(2-chlorophenyl)-(2-fluoro-4-methylphenyl)methanone has a molecular weight of 248.68 g/mol, XLogP of 4.02, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2-chlorophenyl)-(2-fluoro-4-methylphenyl)methanone is sourced from PubChem (CID 114963346), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).