(5-chloro-2-fluorophenyl)-(2-chloro-4-methoxyphenyl)methanone

C14H9Cl2FO2 — CID 43561677

IUPAC(5-chloro-2-fluorophenyl)-(2-chloro-4-methoxyphenyl)methanone
SMILESCOc1ccc(C(=O)c2cc(Cl)ccc2F)c(Cl)c1
InChIInChI=1S/C14H9Cl2FO2/c1-19-9-3-4-10(12(16)7-9)14(18)11-6-8(15)2-5-13(11)17/h2-7H,1H3
InChIKeyVTUFFQKYKAZFFB-UHFFFAOYSA-N
MW299.13 g/mol
LogP4.37
Rot. Bonds3

About (5-chloro-2-fluorophenyl)-(2-chloro-4-methoxyphenyl)methanone

(5-chloro-2-fluorophenyl)-(2-chloro-4-methoxyphenyl)methanone (PubChem CID 43561677) has the molecular formula C14H9Cl2FO2 and a molecular weight of 299.13 g/mol. Its IUPAC name is (5-chloro-2-fluorophenyl)-(2-chloro-4-methoxyphenyl)methanone.

Molecular Properties

Compound Name(5-chloro-2-fluorophenyl)-(2-chloro-4-methoxyphenyl)methanone
PubChem CID43561677
Molecular FormulaC14H9Cl2FO2
Molecular Weight299.13 g/mol
Exact Mass298.00
IUPAC Name(5-chloro-2-fluorophenyl)-(2-chloro-4-methoxyphenyl)methanone
SMILESCOc1ccc(C(=O)c2cc(Cl)ccc2F)c(Cl)c1
InChIInChI=1S/C14H9Cl2FO2/c1-19-9-3-4-10(12(16)7-9)14(18)11-6-8(15)2-5-13(11)17/h2-7H,1H3
InChIKeyVTUFFQKYKAZFFB-UHFFFAOYSA-N
XLogP4.37
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.13
LogP ≤ 54.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

(4-chloro-2,5-difluorophenyl)-(2-chloro-4-methoxyphenyl)methanone
CID 82783216
(2-bromo-4-chlorophenyl)-(2-chloro-4-methoxyphenyl)methanone
CID 107987161
(4-bromo-2-fluorophenyl)-(2-chloro-4-methoxyphenyl)methanone
CID 43561646
(2-chloro-4-methoxyphenyl)-(4-fluoro-3-methylphenyl)methanone
CID 63210027
(5-chloro-2-methoxyphenyl)-(2-fluoro-4-methoxyphenyl)methanone
CID 43561116
(2-chloro-4-methoxyphenyl)-(4-fluoro-2-methylphenyl)methanone
CID 113399945
(5-chloro-2-methoxyphenyl)-(2,4-dichlorophenyl)methanone
CID 63492522
(3-bromo-2-fluorophenyl)-(2-chloro-4-methoxyphenyl)methanone
CID 114019728
(2-chloro-4,5-difluorophenyl)-(5-chloro-2-fluorophenyl)methanone
CID 107475826
(2-bromophenyl)-(2-chloro-4-methoxyphenyl)methanone
CID 43561746
(2-fluoro-5-methoxyphenyl)-(4-methoxyphenyl)methanone
CID 102282476
(4-chlorophenyl)-(2-fluoro-4-methoxyphenyl)methanone
CID 22475222

Frequently Asked Questions

What is the IUPAC name of (5-chloro-2-fluorophenyl)-(2-chloro-4-methoxyphenyl)methanone?
The IUPAC name of (5-chloro-2-fluorophenyl)-(2-chloro-4-methoxyphenyl)methanone (CID 43561677) is (5-chloro-2-fluorophenyl)-(2-chloro-4-methoxyphenyl)methanone.
What is the SMILES notation for (5-chloro-2-fluorophenyl)-(2-chloro-4-methoxyphenyl)methanone?
The canonical SMILES for (5-chloro-2-fluorophenyl)-(2-chloro-4-methoxyphenyl)methanone is COc1ccc(C(=O)c2cc(Cl)ccc2F)c(Cl)c1.
What is the InChIKey of (5-chloro-2-fluorophenyl)-(2-chloro-4-methoxyphenyl)methanone?
The InChIKey is VTUFFQKYKAZFFB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H9Cl2FO2/c1-19-9-3-4-10(12(16)7-9)14(18)11-6-8(15)2-5-13(11)17/h2-7H,1H3.
What are the key properties of (5-chloro-2-fluorophenyl)-(2-chloro-4-methoxyphenyl)methanone?
(5-chloro-2-fluorophenyl)-(2-chloro-4-methoxyphenyl)methanone has a molecular weight of 299.13 g/mol, XLogP of 4.37, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (5-chloro-2-fluorophenyl)-(2-chloro-4-methoxyphenyl)methanone is sourced from PubChem (CID 43561677), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).