2-Chloro-6-methylbenzamide

C₈H₈ClNOCAS 101080-58-4169.61 g/mol

Open in Covalent MOL file

Amide Aryl halide

Properties

Molecular formula: C₈H₈ClNO
Molar mass: 169.61 g/mol
Exact mass: 169.0294 Da
logP: 1.75Crippen estimate
Polar surface area: 43.1 Å²
H-bond donors / acceptors: 1 / 1
Rotatable bonds: 1

Identifiers

CAS number

101080-58-4

SMILES

CC1=C(C(=CC=C1)Cl)C(=O)N

InChIKey

ODGRDDQOHGVCHQ-UHFFFAOYSA-N

InChI

InChI=1S/C8H8ClNO/c1-5-3-2-4-6(9)7(5)8(10)11/h2-4H,1H3,(H2,10,11)

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Type any one amount. The others follow from the molar mass.

Names and synonyms

1 names

Benzamide, 2-chloro-6-methyl-

Work with 2-Chloro-6-methylbenzamide

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

2-Chloro-6-methylbenzoic acid21327-86-659 % similar 3,4-Dimethylbenzamide5580-33-647 % similar 3-Chloro-2-fluorobenzamide104326-94-546 % similar 1-(2,6-Dichlorophenyl)ethanone2040-05-345 % similar 2-Chloro-6-methylaniline87-63-845 % similar 2,6-Dimethylbenzoic acid632-46-244 % similar 2,3-Dichlorotoluene32768-54-044 % similar 1-Chloro-2,3-dimethylbenzene608-23-144 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

N-(2-Chlorophenyl)acetamide533-17-5 N-(4-Chlorophenyl)acetamide539-03-7 Chloroacetanilide587-65-5 N-(3-Chlorophenyl)acetamide588-07-8

Elsewhere

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