(5-chloro-2-methoxyphenyl)-(2,3-difluorophenyl)methanone

C14H9ClF2O2 — CID 113425387

IUPAC(5-chloro-2-methoxyphenyl)-(2,3-difluorophenyl)methanone
SMILESCOc1ccc(Cl)cc1C(=O)c1cccc(F)c1F
InChIInChI=1S/C14H9ClF2O2/c1-19-12-6-5-8(15)7-10(12)14(18)9-3-2-4-11(16)13(9)17/h2-7H,1H3
InChIKeyDLVWSIHRAUNIJX-UHFFFAOYSA-N
MW282.67 g/mol
LogP3.86
Rot. Bonds3

About (5-chloro-2-methoxyphenyl)-(2,3-difluorophenyl)methanone

(5-chloro-2-methoxyphenyl)-(2,3-difluorophenyl)methanone (PubChem CID 113425387) has the molecular formula C14H9ClF2O2 and a molecular weight of 282.67 g/mol. Its IUPAC name is (5-chloro-2-methoxyphenyl)-(2,3-difluorophenyl)methanone.

Molecular Properties

Compound Name(5-chloro-2-methoxyphenyl)-(2,3-difluorophenyl)methanone
PubChem CID113425387
Molecular FormulaC14H9ClF2O2
Molecular Weight282.67 g/mol
Exact Mass282.03
IUPAC Name(5-chloro-2-methoxyphenyl)-(2,3-difluorophenyl)methanone
SMILESCOc1ccc(Cl)cc1C(=O)c1cccc(F)c1F
InChIInChI=1S/C14H9ClF2O2/c1-19-12-6-5-8(15)7-10(12)14(18)9-3-2-4-11(16)13(9)17/h2-7H,1H3
InChIKeyDLVWSIHRAUNIJX-UHFFFAOYSA-N
XLogP3.86
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.67
LogP ≤ 53.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

(2-chloro-3-fluorophenyl)-(5-chloro-2-methoxyphenyl)methanone
CID 112694005
(2-chloro-4,5-dimethoxyphenyl)-(2,3-difluorophenyl)methanone
CID 62649157
(5-chloro-2-methoxyphenyl)-(5-fluoro-2-methoxyphenyl)methanone
CID 43339633
(5-chloro-2-methoxyphenyl)-(2,3-dichlorophenyl)methanone
CID 86028415
(2-amino-5-chlorophenyl)-(2-fluoro-3-methoxyphenyl)methanone
CID 90097176
(2,3-difluorophenyl)-(3-fluoro-4-methoxyphenyl)methanone
CID 57322240
(5-chloro-2-methoxyphenyl)-(2-iodo-3-methylphenyl)methanone
CID 114029899
(3-chloro-2-fluorophenyl)-(2,5-dimethoxyphenyl)methanone
CID 64714149
(5-chloro-2-methoxyphenyl)-(2,4-dichlorophenyl)methanone
CID 63492522
(5-chloro-2-methoxyphenyl)-(2-fluoro-4-methoxyphenyl)methanone
CID 43561116
(2-bromo-4-chlorophenyl)-(2-fluoro-3-methoxyphenyl)methanone
CID 114025571
(5-chloro-2-methoxyphenyl)-(4-fluoro-3-methoxyphenyl)methanone
CID 112694008

Frequently Asked Questions

What is the IUPAC name of (5-chloro-2-methoxyphenyl)-(2,3-difluorophenyl)methanone?
The IUPAC name of (5-chloro-2-methoxyphenyl)-(2,3-difluorophenyl)methanone (CID 113425387) is (5-chloro-2-methoxyphenyl)-(2,3-difluorophenyl)methanone.
What is the SMILES notation for (5-chloro-2-methoxyphenyl)-(2,3-difluorophenyl)methanone?
The canonical SMILES for (5-chloro-2-methoxyphenyl)-(2,3-difluorophenyl)methanone is COc1ccc(Cl)cc1C(=O)c1cccc(F)c1F.
What is the InChIKey of (5-chloro-2-methoxyphenyl)-(2,3-difluorophenyl)methanone?
The InChIKey is DLVWSIHRAUNIJX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H9ClF2O2/c1-19-12-6-5-8(15)7-10(12)14(18)9-3-2-4-11(16)13(9)17/h2-7H,1H3.
What are the key properties of (5-chloro-2-methoxyphenyl)-(2,3-difluorophenyl)methanone?
(5-chloro-2-methoxyphenyl)-(2,3-difluorophenyl)methanone has a molecular weight of 282.67 g/mol, XLogP of 3.86, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (5-chloro-2-methoxyphenyl)-(2,3-difluorophenyl)methanone is sourced from PubChem (CID 113425387), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).