(3-bromo-5-chlorophenyl)-(2-methylphenyl)methanone

C14H10BrClO — CID 107944273

IUPAC(3-bromo-5-chlorophenyl)-(2-methylphenyl)methanone
SMILESCc1ccccc1C(=O)c1cc(Cl)cc(Br)c1
InChIInChI=1S/C14H10BrClO/c1-9-4-2-3-5-13(9)14(17)10-6-11(15)8-12(16)7-10/h2-8H,1H3
InChIKeyJPMWBANQJXLIHD-UHFFFAOYSA-N
MW309.59 g/mol
LogP4.64
Rot. Bonds2

About (3-bromo-5-chlorophenyl)-(2-methylphenyl)methanone

(3-bromo-5-chlorophenyl)-(2-methylphenyl)methanone (PubChem CID 107944273) has the molecular formula C14H10BrClO and a molecular weight of 309.59 g/mol. Its IUPAC name is (3-bromo-5-chlorophenyl)-(2-methylphenyl)methanone.

Molecular Properties

Compound Name(3-bromo-5-chlorophenyl)-(2-methylphenyl)methanone
PubChem CID107944273
Molecular FormulaC14H10BrClO
Molecular Weight309.59 g/mol
Exact Mass307.96
IUPAC Name(3-bromo-5-chlorophenyl)-(2-methylphenyl)methanone
SMILESCc1ccccc1C(=O)c1cc(Cl)cc(Br)c1
InChIInChI=1S/C14H10BrClO/c1-9-4-2-3-5-13(9)14(17)10-6-11(15)8-12(16)7-10/h2-8H,1H3
InChIKeyJPMWBANQJXLIHD-UHFFFAOYSA-N
XLogP4.64
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.59
LogP ≤ 54.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

(3-bromo-5-chlorophenyl)-(2,5-dibromo-4-methylphenyl)methanone
CID 114019744
(3-bromo-5-chlorophenyl)-(4-chloro-2-fluorophenyl)methanone
CID 107944691
(3-chloro-5-methylphenyl)-(2-chlorophenyl)methanone
CID 114963332
(3-bromo-5-chlorophenyl)-(2,5-difluorophenyl)methanone
CID 107944439
(4-bromo-2-methylphenyl)-(2-methylphenyl)methanone
CID 11150419
1,2-bis(3-bromo-5-chlorophenyl)ethane-1,2-dione
CID 139745262
(3-bromo-5-chlorophenyl)-(4-methoxy-3-methylphenyl)methanone
CID 107949805
3-bromo-5-chloro-N-[2-(2-methylphenyl)ethyl]benzamide
CID 107952730
3,5-dichloro-N'-(2-methylbenzoyl)benzohydrazide
CID 17133584
(5-bromothiophen-3-yl)-(2-methylphenyl)methanone
CID 105080186
(3-bromo-5-chlorophenyl)-(2,5-dichloro-4-ethoxyphenyl)methanone
CID 107950013
[2-(2-methylbenzoyl)phenyl]-(2-methylphenyl)methanone
CID 15597717

Frequently Asked Questions

What is the IUPAC name of (3-bromo-5-chlorophenyl)-(2-methylphenyl)methanone?
The IUPAC name of (3-bromo-5-chlorophenyl)-(2-methylphenyl)methanone (CID 107944273) is (3-bromo-5-chlorophenyl)-(2-methylphenyl)methanone.
What is the SMILES notation for (3-bromo-5-chlorophenyl)-(2-methylphenyl)methanone?
The canonical SMILES for (3-bromo-5-chlorophenyl)-(2-methylphenyl)methanone is Cc1ccccc1C(=O)c1cc(Cl)cc(Br)c1.
What is the InChIKey of (3-bromo-5-chlorophenyl)-(2-methylphenyl)methanone?
The InChIKey is JPMWBANQJXLIHD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10BrClO/c1-9-4-2-3-5-13(9)14(17)10-6-11(15)8-12(16)7-10/h2-8H,1H3.
What are the key properties of (3-bromo-5-chlorophenyl)-(2-methylphenyl)methanone?
(3-bromo-5-chlorophenyl)-(2-methylphenyl)methanone has a molecular weight of 309.59 g/mol, XLogP of 4.64, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (3-bromo-5-chlorophenyl)-(2-methylphenyl)methanone is sourced from PubChem (CID 107944273), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).