(5-bromo-2-chlorophenyl)-(2,5-dimethylphenyl)methanone

C15H12BrClO — CID 43378824

IUPAC(5-bromo-2-chlorophenyl)-(2,5-dimethylphenyl)methanone
SMILESCc1ccc(C)c(C(=O)c2cc(Br)ccc2Cl)c1
InChIInChI=1S/C15H12BrClO/c1-9-3-4-10(2)12(7-9)15(18)13-8-11(16)5-6-14(13)17/h3-8H,1-2H3
InChIKeyGXIFNKRBNVTIDR-UHFFFAOYSA-N
MW323.62 g/mol
LogP4.95
Rot. Bonds2

About (5-bromo-2-chlorophenyl)-(2,5-dimethylphenyl)methanone

(5-bromo-2-chlorophenyl)-(2,5-dimethylphenyl)methanone (PubChem CID 43378824) has the molecular formula C15H12BrClO and a molecular weight of 323.62 g/mol. Its IUPAC name is (5-bromo-2-chlorophenyl)-(2,5-dimethylphenyl)methanone.

Molecular Properties

Compound Name(5-bromo-2-chlorophenyl)-(2,5-dimethylphenyl)methanone
PubChem CID43378824
Molecular FormulaC15H12BrClO
Molecular Weight323.62 g/mol
Exact Mass321.98
IUPAC Name(5-bromo-2-chlorophenyl)-(2,5-dimethylphenyl)methanone
SMILESCc1ccc(C)c(C(=O)c2cc(Br)ccc2Cl)c1
InChIInChI=1S/C15H12BrClO/c1-9-3-4-10(2)12(7-9)15(18)13-8-11(16)5-6-14(13)17/h3-8H,1-2H3
InChIKeyGXIFNKRBNVTIDR-UHFFFAOYSA-N
XLogP4.95
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.62
LogP ≤ 54.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

(4-bromo-2-chlorophenyl)-(2,5-dimethylphenyl)methanone
CID 43805047
(5-bromo-2-methylphenyl)-(2-chlorophenyl)methanone
CID 114963344
(5-bromo-2-chlorophenyl)-(4,5-dimethoxy-2-methylphenyl)methanone
CID 43626582
(5-bromo-2-chlorophenyl)-(2,3,5,6-tetramethylphenyl)methanone
CID 43378825
(4-bromo-2-methylphenyl)-(2,5-dichlorophenyl)methanone
CID 43629690
(2-bromo-5-methylphenyl)-(2-chloro-4,5-dimethylphenyl)methanone
CID 113319368
(2-bromo-5-methylphenyl)-(2,5-dichlorophenyl)methanone
CID 81110557
(5-bromo-4-chlorothiophen-2-yl)-(2,5-dimethylphenyl)methanone
CID 80531818
(5-bromo-2-chlorophenyl)-(2-methoxy-4,6-dimethylphenyl)methanone
CID 106681918
(5-bromo-3-methyl-1-benzofuran-2-yl)-(2,5-dimethylphenyl)methanone
CID 28880635
(2-chloro-4-fluorophenyl)-(2,5-dimethylphenyl)methanone
CID 43159718
1-(5-bromo-2-chlorophenyl)-2-(2-chloro-4-methylphenyl)ethanone
CID 106865270

Frequently Asked Questions

What is the IUPAC name of (5-bromo-2-chlorophenyl)-(2,5-dimethylphenyl)methanone?
The IUPAC name of (5-bromo-2-chlorophenyl)-(2,5-dimethylphenyl)methanone (CID 43378824) is (5-bromo-2-chlorophenyl)-(2,5-dimethylphenyl)methanone.
What is the SMILES notation for (5-bromo-2-chlorophenyl)-(2,5-dimethylphenyl)methanone?
The canonical SMILES for (5-bromo-2-chlorophenyl)-(2,5-dimethylphenyl)methanone is Cc1ccc(C)c(C(=O)c2cc(Br)ccc2Cl)c1.
What is the InChIKey of (5-bromo-2-chlorophenyl)-(2,5-dimethylphenyl)methanone?
The InChIKey is GXIFNKRBNVTIDR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12BrClO/c1-9-3-4-10(2)12(7-9)15(18)13-8-11(16)5-6-14(13)17/h3-8H,1-2H3.
What are the key properties of (5-bromo-2-chlorophenyl)-(2,5-dimethylphenyl)methanone?
(5-bromo-2-chlorophenyl)-(2,5-dimethylphenyl)methanone has a molecular weight of 323.62 g/mol, XLogP of 4.95, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (5-bromo-2-chlorophenyl)-(2,5-dimethylphenyl)methanone is sourced from PubChem (CID 43378824), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).