(2,6-dichlorophenyl)-(2-fluoro-4-methoxyphenyl)methanone

C14H9Cl2FO2 — CID 43561133

IUPAC(2,6-dichlorophenyl)-(2-fluoro-4-methoxyphenyl)methanone
SMILESCOc1ccc(C(=O)c2c(Cl)cccc2Cl)c(F)c1
InChIInChI=1S/C14H9Cl2FO2/c1-19-8-5-6-9(12(17)7-8)14(18)13-10(15)3-2-4-11(13)16/h2-7H,1H3
InChIKeyLUGVPEBOGODHSJ-UHFFFAOYSA-N
MW299.13 g/mol
LogP4.37
Rot. Bonds3

About (2,6-dichlorophenyl)-(2-fluoro-4-methoxyphenyl)methanone

(2,6-dichlorophenyl)-(2-fluoro-4-methoxyphenyl)methanone (PubChem CID 43561133) has the molecular formula C14H9Cl2FO2 and a molecular weight of 299.13 g/mol. Its IUPAC name is (2,6-dichlorophenyl)-(2-fluoro-4-methoxyphenyl)methanone.

Molecular Properties

Compound Name(2,6-dichlorophenyl)-(2-fluoro-4-methoxyphenyl)methanone
PubChem CID43561133
Molecular FormulaC14H9Cl2FO2
Molecular Weight299.13 g/mol
Exact Mass298.00
IUPAC Name(2,6-dichlorophenyl)-(2-fluoro-4-methoxyphenyl)methanone
SMILESCOc1ccc(C(=O)c2c(Cl)cccc2Cl)c(F)c1
InChIInChI=1S/C14H9Cl2FO2/c1-19-8-5-6-9(12(17)7-8)14(18)13-10(15)3-2-4-11(13)16/h2-7H,1H3
InChIKeyLUGVPEBOGODHSJ-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

(2,6-difluoro-4-methoxyphenyl)-(2-fluoro-4-methoxyphenyl)methanone
CID 102882225
(3-amino-2-chlorophenyl)-(2-fluoro-4-methoxyphenyl)methanone
CID 112580779
(4-chlorophenyl)-(2-fluoro-4-methoxyphenyl)methanone
CID 22475222
(4-chloro-1H-indol-3-yl)-(2-fluoro-4-methoxyphenyl)methanone
CID 102882290
(4-chloro-2-fluorophenyl)-(2,6-dimethoxyphenyl)methanone
CID 116809979
(5-chloro-2-methoxyphenyl)-(2-fluoro-4-methoxyphenyl)methanone
CID 43561116
(2-fluoro-4-methoxyphenyl)-(2-methoxyphenyl)methanone
CID 43561172
(2,6-dichlorophenyl)-(3,5-dimethoxyphenyl)methanone
CID 112694085
(4-bromo-2-fluorophenyl)-(2-chloro-4-methoxyphenyl)methanone
CID 43561646
2-chloro-6-(2-fluoro-5-methoxyphenyl)benzoic acid
CID 53226527
(4,5-dimethylfuran-2-yl)-(2-fluoro-4-methoxyphenyl)methanone
CID 114248875
(2,6-dichlorophenyl)-(2-fluorophenyl)methanone
CID 13127035

Frequently Asked Questions

What is the IUPAC name of (2,6-dichlorophenyl)-(2-fluoro-4-methoxyphenyl)methanone?
The IUPAC name of (2,6-dichlorophenyl)-(2-fluoro-4-methoxyphenyl)methanone (CID 43561133) is (2,6-dichlorophenyl)-(2-fluoro-4-methoxyphenyl)methanone.
What is the SMILES notation for (2,6-dichlorophenyl)-(2-fluoro-4-methoxyphenyl)methanone?
The canonical SMILES for (2,6-dichlorophenyl)-(2-fluoro-4-methoxyphenyl)methanone is COc1ccc(C(=O)c2c(Cl)cccc2Cl)c(F)c1.
What is the InChIKey of (2,6-dichlorophenyl)-(2-fluoro-4-methoxyphenyl)methanone?
The InChIKey is LUGVPEBOGODHSJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H9Cl2FO2/c1-19-8-5-6-9(12(17)7-8)14(18)13-10(15)3-2-4-11(13)16/h2-7H,1H3.
What are the key properties of (2,6-dichlorophenyl)-(2-fluoro-4-methoxyphenyl)methanone?
(2,6-dichlorophenyl)-(2-fluoro-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 (2,6-dichlorophenyl)-(2-fluoro-4-methoxyphenyl)methanone is sourced from PubChem (CID 43561133), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).