(2-chloro-4-methoxyphenyl)-(4-fluoro-2-methylphenyl)methanone

C15H12ClFO2 — CID 113399945

IUPAC(2-chloro-4-methoxyphenyl)-(4-fluoro-2-methylphenyl)methanone
SMILESCOc1ccc(C(=O)c2ccc(F)cc2C)c(Cl)c1
InChIInChI=1S/C15H12ClFO2/c1-9-7-10(17)3-5-12(9)15(18)13-6-4-11(19-2)8-14(13)16/h3-8H,1-2H3
InChIKeyUFSQCPVCVOSJQA-UHFFFAOYSA-N
MW278.71 g/mol
LogP4.03
Rot. Bonds3

About (2-chloro-4-methoxyphenyl)-(4-fluoro-2-methylphenyl)methanone

(2-chloro-4-methoxyphenyl)-(4-fluoro-2-methylphenyl)methanone (PubChem CID 113399945) has the molecular formula C15H12ClFO2 and a molecular weight of 278.71 g/mol. Its IUPAC name is (2-chloro-4-methoxyphenyl)-(4-fluoro-2-methylphenyl)methanone.

Molecular Properties

Compound Name(2-chloro-4-methoxyphenyl)-(4-fluoro-2-methylphenyl)methanone
PubChem CID113399945
Molecular FormulaC15H12ClFO2
Molecular Weight278.71 g/mol
Exact Mass278.05
IUPAC Name(2-chloro-4-methoxyphenyl)-(4-fluoro-2-methylphenyl)methanone
SMILESCOc1ccc(C(=O)c2ccc(F)cc2C)c(Cl)c1
InChIInChI=1S/C15H12ClFO2/c1-9-7-10(17)3-5-12(9)15(18)13-6-4-11(19-2)8-14(13)16/h3-8H,1-2H3
InChIKeyUFSQCPVCVOSJQA-UHFFFAOYSA-N
XLogP4.03
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.71
LogP ≤ 54.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

(2-chloro-4-methoxyphenyl)-(4-fluoro-3-methylphenyl)methanone
CID 63210027
(4-amino-2-chlorophenyl)-(4-fluoro-2-methylphenyl)methanone
CID 18618724
(5-chloro-2-fluorophenyl)-(2-chloro-4-methoxyphenyl)methanone
CID 43561677
(2-chloro-4-fluorophenyl)-(4-chloro-2-methylphenyl)methanone
CID 146005847
(2-chloro-4-methoxyphenyl)-(3-chloro-4-methylphenyl)methanone
CID 55196391
(4-chloro-2,5-difluorophenyl)-(2-chloro-4-methoxyphenyl)methanone
CID 82783216
(4-bromo-2-fluorophenyl)-(2-chloro-4-methoxyphenyl)methanone
CID 43561646
(5-chloro-2-methoxyphenyl)-(4-fluoro-2-methylphenyl)methanone
CID 81274056
(2-chloro-4,5-dimethoxyphenyl)-(2-chloro-4-fluorophenyl)methanone
CID 43162222
(4-chloro-2-fluorophenyl)-(4-fluoro-2-methylphenyl)methanone
CID 55181742
(3-bromo-2-fluorophenyl)-(2-chloro-4-methoxyphenyl)methanone
CID 114019728
(2-chloro-4-fluorophenyl)-(2-methoxyphenyl)methanone
CID 62946338

Frequently Asked Questions

What is the IUPAC name of (2-chloro-4-methoxyphenyl)-(4-fluoro-2-methylphenyl)methanone?
The IUPAC name of (2-chloro-4-methoxyphenyl)-(4-fluoro-2-methylphenyl)methanone (CID 113399945) is (2-chloro-4-methoxyphenyl)-(4-fluoro-2-methylphenyl)methanone.
What is the SMILES notation for (2-chloro-4-methoxyphenyl)-(4-fluoro-2-methylphenyl)methanone?
The canonical SMILES for (2-chloro-4-methoxyphenyl)-(4-fluoro-2-methylphenyl)methanone is COc1ccc(C(=O)c2ccc(F)cc2C)c(Cl)c1.
What is the InChIKey of (2-chloro-4-methoxyphenyl)-(4-fluoro-2-methylphenyl)methanone?
The InChIKey is UFSQCPVCVOSJQA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12ClFO2/c1-9-7-10(17)3-5-12(9)15(18)13-6-4-11(19-2)8-14(13)16/h3-8H,1-2H3.
What are the key properties of (2-chloro-4-methoxyphenyl)-(4-fluoro-2-methylphenyl)methanone?
(2-chloro-4-methoxyphenyl)-(4-fluoro-2-methylphenyl)methanone has a molecular weight of 278.71 g/mol, XLogP of 4.03, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2-chloro-4-methoxyphenyl)-(4-fluoro-2-methylphenyl)methanone is sourced from PubChem (CID 113399945), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).