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

C15H12ClFO3 — CID 43561116

IUPAC(5-chloro-2-methoxyphenyl)-(2-fluoro-4-methoxyphenyl)methanone
SMILESCOc1ccc(C(=O)c2cc(Cl)ccc2OC)c(F)c1
InChIInChI=1S/C15H12ClFO3/c1-19-10-4-5-11(13(17)8-10)15(18)12-7-9(16)3-6-14(12)20-2/h3-8H,1-2H3
InChIKeyOLCYNENZOSQSBH-UHFFFAOYSA-N
MW294.71 g/mol
LogP3.73
Rot. Bonds4

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

(5-chloro-2-methoxyphenyl)-(2-fluoro-4-methoxyphenyl)methanone (PubChem CID 43561116) has the molecular formula C15H12ClFO3 and a molecular weight of 294.71 g/mol. Its IUPAC name is (5-chloro-2-methoxyphenyl)-(2-fluoro-4-methoxyphenyl)methanone.

Molecular Properties

Compound Name(5-chloro-2-methoxyphenyl)-(2-fluoro-4-methoxyphenyl)methanone
PubChem CID43561116
Molecular FormulaC15H12ClFO3
Molecular Weight294.71 g/mol
Exact Mass294.05
IUPAC Name(5-chloro-2-methoxyphenyl)-(2-fluoro-4-methoxyphenyl)methanone
SMILESCOc1ccc(C(=O)c2cc(Cl)ccc2OC)c(F)c1
InChIInChI=1S/C15H12ClFO3/c1-19-10-4-5-11(13(17)8-10)15(18)12-7-9(16)3-6-14(12)20-2/h3-8H,1-2H3
InChIKeyOLCYNENZOSQSBH-UHFFFAOYSA-N
XLogP3.73
TPSA35.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.71
LogP ≤ 53.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

(2-fluoro-4-methoxyphenyl)-(2-methoxyphenyl)methanone
CID 43561172
(5-chloro-2-methoxyphenyl)-(5-fluoro-2-methoxyphenyl)methanone
CID 43339633
(4-chlorophenyl)-(2-fluoro-4-methoxyphenyl)methanone
CID 22475222
(5-chloro-2-methoxyphenyl)-(2,4-dichlorophenyl)methanone
CID 63492522
(5-chloro-2-fluorophenyl)-(2-chloro-4-methoxyphenyl)methanone
CID 43561677
(5-chloro-2-methoxyphenyl)-(4-fluoro-2-methylphenyl)methanone
CID 81274056
(2-chloro-3-fluorophenyl)-(5-chloro-2-methoxyphenyl)methanone
CID 112694005
(5-chloro-2-methoxyphenyl)-(2,3-difluorophenyl)methanone
CID 113425387
(5-bromo-2-methoxy-4-methylphenyl)-(2-fluoro-4-methoxyphenyl)methanone
CID 102882282
(5-chloro-1H-indol-3-yl)-(2-fluoro-4-methoxyphenyl)methanone
CID 102882260
(5-chloro-2-methoxyphenyl)-(4-fluoro-3-methoxyphenyl)methanone
CID 112694008
(2,4-dimethoxyphenyl)-(5-fluoro-2-methoxyphenyl)methanone
CID 43339638

Frequently Asked Questions

What is the IUPAC name of (5-chloro-2-methoxyphenyl)-(2-fluoro-4-methoxyphenyl)methanone?
The IUPAC name of (5-chloro-2-methoxyphenyl)-(2-fluoro-4-methoxyphenyl)methanone (CID 43561116) is (5-chloro-2-methoxyphenyl)-(2-fluoro-4-methoxyphenyl)methanone.
What is the SMILES notation for (5-chloro-2-methoxyphenyl)-(2-fluoro-4-methoxyphenyl)methanone?
The canonical SMILES for (5-chloro-2-methoxyphenyl)-(2-fluoro-4-methoxyphenyl)methanone is COc1ccc(C(=O)c2cc(Cl)ccc2OC)c(F)c1.
What is the InChIKey of (5-chloro-2-methoxyphenyl)-(2-fluoro-4-methoxyphenyl)methanone?
The InChIKey is OLCYNENZOSQSBH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12ClFO3/c1-19-10-4-5-11(13(17)8-10)15(18)12-7-9(16)3-6-14(12)20-2/h3-8H,1-2H3.
What are the key properties of (5-chloro-2-methoxyphenyl)-(2-fluoro-4-methoxyphenyl)methanone?
(5-chloro-2-methoxyphenyl)-(2-fluoro-4-methoxyphenyl)methanone has a molecular weight of 294.71 g/mol, XLogP of 3.73, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (5-chloro-2-methoxyphenyl)-(2-fluoro-4-methoxyphenyl)methanone is sourced from PubChem (CID 43561116), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).