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

C15H12ClFO — CID 43160123

IUPAC(4-chloro-2-fluorophenyl)-(2,4-dimethylphenyl)methanone
SMILESCc1ccc(C(=O)c2ccc(Cl)cc2F)c(C)c1
InChIInChI=1S/C15H12ClFO/c1-9-3-5-12(10(2)7-9)15(18)13-6-4-11(16)8-14(13)17/h3-8H,1-2H3
InChIKeyOKOFZVYBXNFWEJ-UHFFFAOYSA-N
MW262.71 g/mol
LogP4.33
Rot. Bonds2

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

(4-chloro-2-fluorophenyl)-(2,4-dimethylphenyl)methanone (PubChem CID 43160123) has the molecular formula C15H12ClFO and a molecular weight of 262.71 g/mol. Its IUPAC name is (4-chloro-2-fluorophenyl)-(2,4-dimethylphenyl)methanone.

Molecular Properties

Compound Name(4-chloro-2-fluorophenyl)-(2,4-dimethylphenyl)methanone
PubChem CID43160123
Molecular FormulaC15H12ClFO
Molecular Weight262.71 g/mol
Exact Mass262.06
IUPAC Name(4-chloro-2-fluorophenyl)-(2,4-dimethylphenyl)methanone
SMILESCc1ccc(C(=O)c2ccc(Cl)cc2F)c(C)c1
InChIInChI=1S/C15H12ClFO/c1-9-3-5-12(10(2)7-9)15(18)13-6-4-11(16)8-14(13)17/h3-8H,1-2H3
InChIKeyOKOFZVYBXNFWEJ-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

(4-chloro-2-fluorophenyl)-(4-fluoro-2-methylphenyl)methanone
CID 55181742
(2-amino-5-methylphenyl)-(4-chloro-2-fluorophenyl)methanone
CID 116581480
(2-chloro-4-fluoro-5-methylphenyl)-(4-chloro-2-fluorophenyl)methanone
CID 81045884
(2-chlorophenyl)-(2-fluoro-4-methylphenyl)methanone
CID 114963346
(3-chloro-2-fluorophenyl)-(2,4-dimethylphenyl)methanone
CID 64712749
(2-chloro-4-fluorophenyl)-(4-chloro-2-methylphenyl)methanone
CID 146005847
(2,4-dimethylphenyl)-(2,4,6-trifluorophenyl)methanone
CID 43338550
(2,4-dimethylphenyl)-(2-fluoro-4,6-dimethylphenyl)methanone
CID 106883185
(4-chloro-2-fluorophenyl)-(3,4-difluorophenyl)methanone
CID 43338232
(2-fluoro-4-methylphenyl)-(3-fluoro-4-methylphenyl)methanone
CID 107129912
(4-chloro-2-fluorophenyl)-(5-chloro-4-methylthiophen-2-yl)methanone
CID 102762924
1-(4-chloro-2-fluorophenyl)-2-(2,4,6-trimethylphenyl)ethanone
CID 63410206

Frequently Asked Questions

What is the IUPAC name of (4-chloro-2-fluorophenyl)-(2,4-dimethylphenyl)methanone?
The IUPAC name of (4-chloro-2-fluorophenyl)-(2,4-dimethylphenyl)methanone (CID 43160123) is (4-chloro-2-fluorophenyl)-(2,4-dimethylphenyl)methanone.
What is the SMILES notation for (4-chloro-2-fluorophenyl)-(2,4-dimethylphenyl)methanone?
The canonical SMILES for (4-chloro-2-fluorophenyl)-(2,4-dimethylphenyl)methanone is Cc1ccc(C(=O)c2ccc(Cl)cc2F)c(C)c1.
What is the InChIKey of (4-chloro-2-fluorophenyl)-(2,4-dimethylphenyl)methanone?
The InChIKey is OKOFZVYBXNFWEJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12ClFO/c1-9-3-5-12(10(2)7-9)15(18)13-6-4-11(16)8-14(13)17/h3-8H,1-2H3.
What are the key properties of (4-chloro-2-fluorophenyl)-(2,4-dimethylphenyl)methanone?
(4-chloro-2-fluorophenyl)-(2,4-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 (4-chloro-2-fluorophenyl)-(2,4-dimethylphenyl)methanone is sourced from PubChem (CID 43160123), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).