(2-chloro-3-fluorophenyl)-(4-chloro-3-methylphenyl)methanone

C14H9Cl2FO — CID 146005889

IUPAC(2-chloro-3-fluorophenyl)-(4-chloro-3-methylphenyl)methanone
SMILESCc1cc(C(=O)c2cccc(F)c2Cl)ccc1Cl
InChIInChI=1S/C14H9Cl2FO/c1-8-7-9(5-6-11(8)15)14(18)10-3-2-4-12(17)13(10)16/h2-7H,1H3
InChIKeyYNEWFNNTEHXYQN-UHFFFAOYSA-N
MW283.13 g/mol
LogP4.67
Rot. Bonds2

About (2-chloro-3-fluorophenyl)-(4-chloro-3-methylphenyl)methanone

(2-chloro-3-fluorophenyl)-(4-chloro-3-methylphenyl)methanone (PubChem CID 146005889) has the molecular formula C14H9Cl2FO and a molecular weight of 283.13 g/mol. Its IUPAC name is (2-chloro-3-fluorophenyl)-(4-chloro-3-methylphenyl)methanone.

Molecular Properties

Compound Name(2-chloro-3-fluorophenyl)-(4-chloro-3-methylphenyl)methanone
PubChem CID146005889
Molecular FormulaC14H9Cl2FO
Molecular Weight283.13 g/mol
Exact Mass282.00
IUPAC Name(2-chloro-3-fluorophenyl)-(4-chloro-3-methylphenyl)methanone
SMILESCc1cc(C(=O)c2cccc(F)c2Cl)ccc1Cl
InChIInChI=1S/C14H9Cl2FO/c1-8-7-9(5-6-11(8)15)14(18)10-3-2-4-12(17)13(10)16/h2-7H,1H3
InChIKeyYNEWFNNTEHXYQN-UHFFFAOYSA-N
XLogP4.67
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.13
LogP ≤ 54.67
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

(3-bromo-2-chlorophenyl)-(4-fluoro-3-methylphenyl)methanone
CID 113402904
(2-chloro-3-fluorophenyl)-(5-chloro-2-methylphenyl)methanone
CID 146005923
[4-(4-chloro-3-methylbenzoyl)phenyl]-(4-chloro-3-methylphenyl)methanone
CID 5143805
(2-chloro-3-fluorophenyl)-(5-fluoro-2-methylphenyl)methanone
CID 112694145
(2-chloro-3-fluorophenyl)-[2-methyl-4-(trifluoromethyl)phenyl]methanone
CID 102757184
(2-chloro-3-fluorophenyl)-(4-methoxy-2,5-dimethylphenyl)methanone
CID 115797667
(4-chloro-3-methylphenyl)-(3-methylphenyl)methanone
CID 112694024
(2-chloro-3-methylphenyl)-[4-fluoro-3-(trifluoromethyl)phenyl]methanone
CID 107291351
(2-chloro-3-fluorophenyl)-[4-(2-methylpropyl)phenyl]methanone
CID 81454343
(2-chloro-3-fluorophenyl)-(2,2-dimethyl-3H-1-benzofuran-5-yl)methanone
CID 81454812
(5-amino-2-chlorophenyl)-(4-fluoro-3-methylphenyl)methanone
CID 79736594
(3-amino-2-chlorophenyl)-(4-fluoro-3,5-dimethylphenyl)methanone
CID 112580805

Frequently Asked Questions

What is the IUPAC name of (2-chloro-3-fluorophenyl)-(4-chloro-3-methylphenyl)methanone?
The IUPAC name of (2-chloro-3-fluorophenyl)-(4-chloro-3-methylphenyl)methanone (CID 146005889) is (2-chloro-3-fluorophenyl)-(4-chloro-3-methylphenyl)methanone.
What is the SMILES notation for (2-chloro-3-fluorophenyl)-(4-chloro-3-methylphenyl)methanone?
The canonical SMILES for (2-chloro-3-fluorophenyl)-(4-chloro-3-methylphenyl)methanone is Cc1cc(C(=O)c2cccc(F)c2Cl)ccc1Cl.
What is the InChIKey of (2-chloro-3-fluorophenyl)-(4-chloro-3-methylphenyl)methanone?
The InChIKey is YNEWFNNTEHXYQN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H9Cl2FO/c1-8-7-9(5-6-11(8)15)14(18)10-3-2-4-12(17)13(10)16/h2-7H,1H3.
What are the key properties of (2-chloro-3-fluorophenyl)-(4-chloro-3-methylphenyl)methanone?
(2-chloro-3-fluorophenyl)-(4-chloro-3-methylphenyl)methanone has a molecular weight of 283.13 g/mol, XLogP of 4.67, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2-chloro-3-fluorophenyl)-(4-chloro-3-methylphenyl)methanone is sourced from PubChem (CID 146005889), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).