(2,4-dichlorophenyl)-(2,4-difluorophenyl)methanone

C13H6Cl2F2O — CID 43159987

IUPAC(2,4-dichlorophenyl)-(2,4-difluorophenyl)methanone
SMILESO=C(c1ccc(F)cc1F)c1ccc(Cl)cc1Cl
InChIInChI=1S/C13H6Cl2F2O/c14-7-1-3-9(11(15)5-7)13(18)10-4-2-8(16)6-12(10)17/h1-6H
InChIKeyDXBKHJSMPNAVMH-UHFFFAOYSA-N
MW287.09 g/mol
LogP4.50
Rot. Bonds2

About (2,4-dichlorophenyl)-(2,4-difluorophenyl)methanone

(2,4-dichlorophenyl)-(2,4-difluorophenyl)methanone (PubChem CID 43159987) has the molecular formula C13H6Cl2F2O and a molecular weight of 287.09 g/mol. Its IUPAC name is (2,4-dichlorophenyl)-(2,4-difluorophenyl)methanone.

Molecular Properties

Compound Name(2,4-dichlorophenyl)-(2,4-difluorophenyl)methanone
PubChem CID43159987
Molecular FormulaC13H6Cl2F2O
Molecular Weight287.09 g/mol
Exact Mass285.98
IUPAC Name(2,4-dichlorophenyl)-(2,4-difluorophenyl)methanone
SMILESO=C(c1ccc(F)cc1F)c1ccc(Cl)cc1Cl
InChIInChI=1S/C13H6Cl2F2O/c14-7-1-3-9(11(15)5-7)13(18)10-4-2-8(16)6-12(10)17/h1-6H
InChIKeyDXBKHJSMPNAVMH-UHFFFAOYSA-N
XLogP4.50
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.09
LogP ≤ 54.50
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

(2-chloro-4-fluorophenyl)-(4-chloro-2-methylphenyl)methanone
CID 146005847
(4-chloro-2-fluorophenyl)-(4-fluoro-2-methylphenyl)methanone
CID 55181742
(2,4-dichlorophenyl)-(2,5-dichlorophenyl)methanone
CID 43344575
(2,4-dichlorophenyl)-(3-fluorophenyl)methanone
CID 61271846
(6-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)-(2,4-difluorophenyl)methanone
CID 43340605
(2,4-dichlorophenyl)-(3,4,5-trifluorophenyl)methanone
CID 63187591
(3-chloro-2-fluorophenyl)-(2,4-dichlorophenyl)methanone
CID 81265376
(2,4-dichlorophenyl)-(3,4-difluorophenyl)methanone
CID 43338229
(2-chloro-4-fluoro-5-methylphenyl)-(4-chloro-2-fluorophenyl)methanone
CID 81045884
(2-bromo-4-fluorophenyl)-(2,4-difluorophenyl)methanone
CID 43160008
2-(2,5-dichlorophenyl)-1-(2,4-difluorophenyl)ethanone
CID 65317205
(2,4-dichlorophenyl)-(4-hydroxyphenyl)methanone
CID 13453357

Frequently Asked Questions

What is the IUPAC name of (2,4-dichlorophenyl)-(2,4-difluorophenyl)methanone?
The IUPAC name of (2,4-dichlorophenyl)-(2,4-difluorophenyl)methanone (CID 43159987) is (2,4-dichlorophenyl)-(2,4-difluorophenyl)methanone.
What is the SMILES notation for (2,4-dichlorophenyl)-(2,4-difluorophenyl)methanone?
The canonical SMILES for (2,4-dichlorophenyl)-(2,4-difluorophenyl)methanone is O=C(c1ccc(F)cc1F)c1ccc(Cl)cc1Cl.
What is the InChIKey of (2,4-dichlorophenyl)-(2,4-difluorophenyl)methanone?
The InChIKey is DXBKHJSMPNAVMH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H6Cl2F2O/c14-7-1-3-9(11(15)5-7)13(18)10-4-2-8(16)6-12(10)17/h1-6H.
What are the key properties of (2,4-dichlorophenyl)-(2,4-difluorophenyl)methanone?
(2,4-dichlorophenyl)-(2,4-difluorophenyl)methanone has a molecular weight of 287.09 g/mol, XLogP of 4.50, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2,4-dichlorophenyl)-(2,4-difluorophenyl)methanone is sourced from PubChem (CID 43159987), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).