Methyl N-(4-methylphenyl)carbamate

C₉H₁₁NO₂CAS 5602-96-0165.19 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₉H₁₁NO₂
Molar mass: 165.19 g/mol
Exact mass: 165.0790 Da
Melting point: 44–45 °C
logP: 2.17Crippen estimate
Polar surface area: 38.3 Å²
H-bond donors / acceptors: 1 / 2
Rotatable bonds: 1

Identifiers

CAS number

5602-96-0

SMILES

COC(=O)Nc1ccc(C)cc1

InChIKey

OKBJVCWRESLMMD-UHFFFAOYSA-N

InChI

InChI=1S/C9H11NO2/c1-7-3-5-8(6-4-7)10-9(11)12-2/h3-6H,1-2H3,(H,10,11)

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

Names and synonyms

8 names

Carbamic acid, N-(4-methylphenyl)-, methyl ester
Carbamic acid, (4-methylphenyl)-, methyl ester
Carbanilic acid, p-methyl-, methyl ester
Methyl p-tolylcarbamate
Methyl (4-methylphenyl)carbamate
Methyl N-p-tolylcarbamate
Methyl p-methylcarbanilate
Methyl (p-methylphenyl)carbamate

Work with Methyl N-(4-methylphenyl)carbamate

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

Methyl P-toluate99-75-253 % similar 2-Chloro-N-(4-methylphenyl)acetamide16634-82-547 % similar N,N′-Bis(4-methylphenyl)thiourea621-01-247 % similar N-(4-Methylphenyl)-3-oxobutanamide2415-85-245 % similar p-Tolylacetic acid methyl ester23786-13-244 % similar N-(4-Methylphenyl)urea622-51-543 % similar (4-Methylphenyl)thiourea622-52-643 % similar Bis(4-methylphenyl)amine620-93-941 % similar

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

Same formula

Ethyl N-phenylcarbamate101-99-5 Metolcarb1129-41-5 2-Amino-2-(4-methylphenyl)acetic acid13227-01-5 (+)-3-Amino-3-phenylpropanoic acid13921-90-9 1,3-Benzodioxole-5-ethanamine1484-85-1 Dl-phenylalanine150-30-1 3-(3-Aminophenyl)propionic acid1664-54-6 N-(4-Hydroxyphenyl)propanamide1693-37-4

Elsewhere

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