(2-chloro-3-fluorophenyl)-(5-chloro-2-methoxyphenyl)methanone

C14H9Cl2FO2 — CID 112694005

IUPAC(2-chloro-3-fluorophenyl)-(5-chloro-2-methoxyphenyl)methanone
SMILESCOc1ccc(Cl)cc1C(=O)c1cccc(F)c1Cl
InChIInChI=1S/C14H9Cl2FO2/c1-19-12-6-5-8(15)7-10(12)14(18)9-3-2-4-11(17)13(9)16/h2-7H,1H3
InChIKeyAUXSFXKBGOLNOG-UHFFFAOYSA-N
MW299.13 g/mol
LogP4.37
Rot. Bonds3

About (2-chloro-3-fluorophenyl)-(5-chloro-2-methoxyphenyl)methanone

(2-chloro-3-fluorophenyl)-(5-chloro-2-methoxyphenyl)methanone (PubChem CID 112694005) has the molecular formula C14H9Cl2FO2 and a molecular weight of 299.13 g/mol. Its IUPAC name is (2-chloro-3-fluorophenyl)-(5-chloro-2-methoxyphenyl)methanone.

Molecular Properties

Compound Name(2-chloro-3-fluorophenyl)-(5-chloro-2-methoxyphenyl)methanone
PubChem CID112694005
Molecular FormulaC14H9Cl2FO2
Molecular Weight299.13 g/mol
Exact Mass298.00
IUPAC Name(2-chloro-3-fluorophenyl)-(5-chloro-2-methoxyphenyl)methanone
SMILESCOc1ccc(Cl)cc1C(=O)c1cccc(F)c1Cl
InChIInChI=1S/C14H9Cl2FO2/c1-19-12-6-5-8(15)7-10(12)14(18)9-3-2-4-11(17)13(9)16/h2-7H,1H3
InChIKeyAUXSFXKBGOLNOG-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

(5-chloro-2-methoxyphenyl)-(2,3-difluorophenyl)methanone
CID 113425387
(5-chloro-2-methoxyphenyl)-(2,3-dichlorophenyl)methanone
CID 86028415
(5-chloro-2-methoxyphenyl)-(5-fluoro-2-methoxyphenyl)methanone
CID 43339633
(2-chloro-3-fluorophenyl)-(5-chloro-2-methylphenyl)methanone
CID 146005923
(2-chloro-3-fluorophenyl)-(4-methoxy-2,5-dimethylphenyl)methanone
CID 115797667
(5-chloro-2-methoxyphenyl)-(2-iodo-3-methylphenyl)methanone
CID 114029899
(5-chloro-2-methoxyphenyl)-(2,4-dichlorophenyl)methanone
CID 63492522
(5-chloro-2-methoxyphenyl)-(2-fluoro-4-methoxyphenyl)methanone
CID 43561116
(5-chloro-2-methoxyphenyl)-(4-fluoro-3-methoxyphenyl)methanone
CID 112694008
(2-tert-butylphenyl)-(5-chloro-2-methoxyphenyl)methanone
CID 104544982
(5-chloro-2-methoxyphenyl)-(4-fluoro-2-methylphenyl)methanone
CID 81274056
(5-chloro-2-methoxyphenyl)-(2,5-dimethylthiophen-3-yl)methanone
CID 43339476

Frequently Asked Questions

What is the IUPAC name of (2-chloro-3-fluorophenyl)-(5-chloro-2-methoxyphenyl)methanone?
The IUPAC name of (2-chloro-3-fluorophenyl)-(5-chloro-2-methoxyphenyl)methanone (CID 112694005) is (2-chloro-3-fluorophenyl)-(5-chloro-2-methoxyphenyl)methanone.
What is the SMILES notation for (2-chloro-3-fluorophenyl)-(5-chloro-2-methoxyphenyl)methanone?
The canonical SMILES for (2-chloro-3-fluorophenyl)-(5-chloro-2-methoxyphenyl)methanone is COc1ccc(Cl)cc1C(=O)c1cccc(F)c1Cl.
What is the InChIKey of (2-chloro-3-fluorophenyl)-(5-chloro-2-methoxyphenyl)methanone?
The InChIKey is AUXSFXKBGOLNOG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H9Cl2FO2/c1-19-12-6-5-8(15)7-10(12)14(18)9-3-2-4-11(17)13(9)16/h2-7H,1H3.
What are the key properties of (2-chloro-3-fluorophenyl)-(5-chloro-2-methoxyphenyl)methanone?
(2-chloro-3-fluorophenyl)-(5-chloro-2-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 (2-chloro-3-fluorophenyl)-(5-chloro-2-methoxyphenyl)methanone is sourced from PubChem (CID 112694005), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).