(2-chloro-4-fluorophenyl)-(2,5-dimethylphenyl)methanone

C15H12ClFO — CID 43159718

IUPAC(2-chloro-4-fluorophenyl)-(2,5-dimethylphenyl)methanone
SMILESCc1ccc(C)c(C(=O)c2ccc(F)cc2Cl)c1
InChIInChI=1S/C15H12ClFO/c1-9-3-4-10(2)13(7-9)15(18)12-6-5-11(17)8-14(12)16/h3-8H,1-2H3
InChIKeyIPVMWEXKWIHKJX-UHFFFAOYSA-N
MW262.71 g/mol
LogP4.33
Rot. Bonds2

About (2-chloro-4-fluorophenyl)-(2,5-dimethylphenyl)methanone

(2-chloro-4-fluorophenyl)-(2,5-dimethylphenyl)methanone (PubChem CID 43159718) has the molecular formula C15H12ClFO and a molecular weight of 262.71 g/mol. Its IUPAC name is (2-chloro-4-fluorophenyl)-(2,5-dimethylphenyl)methanone.

Molecular Properties

Compound Name(2-chloro-4-fluorophenyl)-(2,5-dimethylphenyl)methanone
PubChem CID43159718
Molecular FormulaC15H12ClFO
Molecular Weight262.71 g/mol
Exact Mass262.06
IUPAC Name(2-chloro-4-fluorophenyl)-(2,5-dimethylphenyl)methanone
SMILESCc1ccc(C)c(C(=O)c2ccc(F)cc2Cl)c1
InChIInChI=1S/C15H12ClFO/c1-9-3-4-10(2)13(7-9)15(18)12-6-5-11(17)8-14(12)16/h3-8H,1-2H3
InChIKeyIPVMWEXKWIHKJX-UHFFFAOYSA-N
XLogP4.33
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.71
LogP ≤ 54.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

(2-chloro-4-fluorophenyl)-(4-methyl-2-methylsulfanylphenyl)methanone
CID 142346682
(4-bromo-2-chlorophenyl)-(2,5-dimethylphenyl)methanone
CID 43805047
(2-bromo-4-fluorophenyl)-(2,5-dimethylphenyl)methanone
CID 43337277
(2,5-difluorophenyl)-(2,5-dimethylphenyl)methanone
CID 43337442
(2-chloro-4-fluorophenyl)-(4-chloro-2-methylphenyl)methanone
CID 146005847
(3-chloro-2-fluorophenyl)-(2,5-dimethylphenyl)methanone
CID 64713968
(2-chloro-4-methylphenyl)-(2,4,5-trimethylphenyl)methanone
CID 106864991
(4-chloronaphthalen-1-yl)-(5-fluoro-2-methylphenyl)methanone
CID 79591384
(2-chlorophenyl)-(2-fluoro-4-methylphenyl)methanone
CID 114963346
(4-amino-2-chlorophenyl)-(4-fluoro-2-methylphenyl)methanone
CID 18618724
(2-chloro-4-fluorophenyl)-(2-methoxyphenyl)methanone
CID 62946338
(2-chloro-4-methylphenyl)-(6-fluoro-1H-indol-3-yl)methanone
CID 106860788

Frequently Asked Questions

What is the IUPAC name of (2-chloro-4-fluorophenyl)-(2,5-dimethylphenyl)methanone?
The IUPAC name of (2-chloro-4-fluorophenyl)-(2,5-dimethylphenyl)methanone (CID 43159718) is (2-chloro-4-fluorophenyl)-(2,5-dimethylphenyl)methanone.
What is the SMILES notation for (2-chloro-4-fluorophenyl)-(2,5-dimethylphenyl)methanone?
The canonical SMILES for (2-chloro-4-fluorophenyl)-(2,5-dimethylphenyl)methanone is Cc1ccc(C)c(C(=O)c2ccc(F)cc2Cl)c1.
What is the InChIKey of (2-chloro-4-fluorophenyl)-(2,5-dimethylphenyl)methanone?
The InChIKey is IPVMWEXKWIHKJX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12ClFO/c1-9-3-4-10(2)13(7-9)15(18)12-6-5-11(17)8-14(12)16/h3-8H,1-2H3.
What are the key properties of (2-chloro-4-fluorophenyl)-(2,5-dimethylphenyl)methanone?
(2-chloro-4-fluorophenyl)-(2,5-dimethylphenyl)methanone has a molecular weight of 262.71 g/mol, XLogP of 4.33, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2-chloro-4-fluorophenyl)-(2,5-dimethylphenyl)methanone is sourced from PubChem (CID 43159718), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).