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

C14H10BrClO — CID 114963344

IUPAC(5-bromo-2-methylphenyl)-(2-chlorophenyl)methanone
SMILESCc1ccc(Br)cc1C(=O)c1ccccc1Cl
InChIInChI=1S/C14H10BrClO/c1-9-6-7-10(15)8-12(9)14(17)11-4-2-3-5-13(11)16/h2-8H,1H3
InChIKeyLNDFBXNANDSJCB-UHFFFAOYSA-N
MW309.59 g/mol
LogP4.64
Rot. Bonds2

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

(5-bromo-2-methylphenyl)-(2-chlorophenyl)methanone (PubChem CID 114963344) has the molecular formula C14H10BrClO and a molecular weight of 309.59 g/mol. Its IUPAC name is (5-bromo-2-methylphenyl)-(2-chlorophenyl)methanone.

Molecular Properties

Compound Name(5-bromo-2-methylphenyl)-(2-chlorophenyl)methanone
PubChem CID114963344
Molecular FormulaC14H10BrClO
Molecular Weight309.59 g/mol
Exact Mass307.96
IUPAC Name(5-bromo-2-methylphenyl)-(2-chlorophenyl)methanone
SMILESCc1ccc(Br)cc1C(=O)c1ccccc1Cl
InChIInChI=1S/C14H10BrClO/c1-9-6-7-10(15)8-12(9)14(17)11-4-2-3-5-13(11)16/h2-8H,1H3
InChIKeyLNDFBXNANDSJCB-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

(5-bromo-2-chlorophenyl)-(2,5-dimethylphenyl)methanone
CID 43378824
(4-bromo-2-chlorophenyl)-(2,5-dimethylphenyl)methanone
CID 43805047
(5-bromo-2-methoxyphenyl)-(2-chlorophenyl)methanone
CID 43339911
(2-chlorophenyl)-(2,4-dibromophenyl)methanone
CID 107944284
(2,5-dibromophenyl)-(2-methylphenyl)methanone
CID 114962947
(4-bromo-2-methylphenyl)-(2-methylphenyl)methanone
CID 11150419
5-bromo-N-(2-chlorophenyl)-2-methylbenzamide
CID 65306919
(2-amino-5-bromophenyl)-(3-chloro-2-methylphenyl)methanone
CID 25257909
(5-bromo-2-methylphenyl)-[2-(trifluoromethoxy)phenyl]methanone
CID 114970316
[4-(4-bromoanilino)-2-chlorophenyl]-(2-methylphenyl)methanone
CID 10201018
5-bromo-N-[1-(2-chlorophenyl)ethyl]-2-methylbenzamide
CID 65311511
(5-bromo-2-chlorophenyl)-(2-methylnaphthalen-1-yl)methanone
CID 81430855

Frequently Asked Questions

What is the IUPAC name of (5-bromo-2-methylphenyl)-(2-chlorophenyl)methanone?
The IUPAC name of (5-bromo-2-methylphenyl)-(2-chlorophenyl)methanone (CID 114963344) is (5-bromo-2-methylphenyl)-(2-chlorophenyl)methanone.
What is the SMILES notation for (5-bromo-2-methylphenyl)-(2-chlorophenyl)methanone?
The canonical SMILES for (5-bromo-2-methylphenyl)-(2-chlorophenyl)methanone is Cc1ccc(Br)cc1C(=O)c1ccccc1Cl.
What is the InChIKey of (5-bromo-2-methylphenyl)-(2-chlorophenyl)methanone?
The InChIKey is LNDFBXNANDSJCB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10BrClO/c1-9-6-7-10(15)8-12(9)14(17)11-4-2-3-5-13(11)16/h2-8H,1H3.
What are the key properties of (5-bromo-2-methylphenyl)-(2-chlorophenyl)methanone?
(5-bromo-2-methylphenyl)-(2-chlorophenyl)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 (5-bromo-2-methylphenyl)-(2-chlorophenyl)methanone is sourced from PubChem (CID 114963344), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).