(2,4-dibromophenyl)-(2,3-dichlorophenyl)methanone

C13H6Br2Cl2O — CID 107944424

IUPAC(2,4-dibromophenyl)-(2,3-dichlorophenyl)methanone
SMILESO=C(c1ccc(Br)cc1Br)c1cccc(Cl)c1Cl
InChIInChI=1S/C13H6Br2Cl2O/c14-7-4-5-8(10(15)6-7)13(18)9-2-1-3-11(16)12(9)17/h1-6H
InChIKeyVNMIHRJVCWHJMP-UHFFFAOYSA-N
MW408.90 g/mol
LogP5.75
Rot. Bonds2

About (2,4-dibromophenyl)-(2,3-dichlorophenyl)methanone

(2,4-dibromophenyl)-(2,3-dichlorophenyl)methanone (PubChem CID 107944424) has the molecular formula C13H6Br2Cl2O and a molecular weight of 408.90 g/mol. Its IUPAC name is (2,4-dibromophenyl)-(2,3-dichlorophenyl)methanone.

Molecular Properties

Compound Name(2,4-dibromophenyl)-(2,3-dichlorophenyl)methanone
PubChem CID107944424
Molecular FormulaC13H6Br2Cl2O
Molecular Weight408.90 g/mol
Exact Mass405.82
IUPAC Name(2,4-dibromophenyl)-(2,3-dichlorophenyl)methanone
SMILESO=C(c1ccc(Br)cc1Br)c1cccc(Cl)c1Cl
InChIInChI=1S/C13H6Br2Cl2O/c14-7-4-5-8(10(15)6-7)13(18)9-2-1-3-11(16)12(9)17/h1-6H
InChIKeyVNMIHRJVCWHJMP-UHFFFAOYSA-N
XLogP5.75
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500408.90
LogP ≤ 55.75
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

(2-chlorophenyl)-(2,4-dibromophenyl)methanone
CID 107944284
(2,4-dibromophenyl)-(2,5-dichlorothiophen-3-yl)methanone
CID 107949791
3-chloro-2-[(2,4-dibromobenzoyl)amino]benzoic acid
CID 107938398
(4-amino-2-bromophenyl)-(2-chloro-3-fluorophenyl)methanone
CID 81461861
(4-amino-2-bromophenyl)-(3-chloro-2-methylphenyl)methanone
CID 107100346
(5-bromo-2-methylphenyl)-(2-chlorophenyl)methanone
CID 114963344
(7-bromo-1-benzothiophen-3-yl)-(2,3-dichlorophenyl)methanone
CID 81141972
2-(4-bromo-2-fluorophenyl)-1-(2,3-dichlorophenyl)ethanone
CID 114968448
(2-amino-5-bromophenyl)-(3-chloro-2-methylphenyl)methanone
CID 25257909
(2,4-dibromophenyl)-isoquinolin-5-ylmethanone
CID 107944438
2,4-dibromo-N-(3-chloro-2-methylphenyl)benzamide
CID 113345152
(3-amino-2-chlorophenyl)-(2-bromo-4-methoxyphenyl)methanone
CID 112580783

Frequently Asked Questions

What is the IUPAC name of (2,4-dibromophenyl)-(2,3-dichlorophenyl)methanone?
The IUPAC name of (2,4-dibromophenyl)-(2,3-dichlorophenyl)methanone (CID 107944424) is (2,4-dibromophenyl)-(2,3-dichlorophenyl)methanone.
What is the SMILES notation for (2,4-dibromophenyl)-(2,3-dichlorophenyl)methanone?
The canonical SMILES for (2,4-dibromophenyl)-(2,3-dichlorophenyl)methanone is O=C(c1ccc(Br)cc1Br)c1cccc(Cl)c1Cl.
What is the InChIKey of (2,4-dibromophenyl)-(2,3-dichlorophenyl)methanone?
The InChIKey is VNMIHRJVCWHJMP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H6Br2Cl2O/c14-7-4-5-8(10(15)6-7)13(18)9-2-1-3-11(16)12(9)17/h1-6H.
What are the key properties of (2,4-dibromophenyl)-(2,3-dichlorophenyl)methanone?
(2,4-dibromophenyl)-(2,3-dichlorophenyl)methanone has a molecular weight of 408.90 g/mol, XLogP of 5.75, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2,4-dibromophenyl)-(2,3-dichlorophenyl)methanone is sourced from PubChem (CID 107944424), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).