Benzyl N-hydroxycarbamate

C₈H₉NO₃CAS 3426-71-9167.16 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₈H₉NO₃
Molar mass: 167.16 g/mol
Exact mass: 167.0582 Da
Melting point: 68–69 °C
logP: 1.51Crippen estimate
Polar surface area: 62.0 Å²
H-bond donors / acceptors: 2 / 3
Rotatable bonds: 2

Identifiers

CAS number

3426-71-9

SMILES

ON=C(O)OCc1ccccc1

InChIKey

PQBSPTAPCMSZAA-UHFFFAOYSA-N

InChI

InChI=1S/C8H9NO3/c10-8(9-11)12-6-7-4-2-1-3-5-7/h1-5,11H,6H2,(H,9,10)

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Names and synonyms

8 names

Carbamic acid, N-hydroxy-, phenylmethyl ester
Carbamic acid, hydroxy-, benzyl ester
Carbamic acid, hydroxy-, phenylmethyl ester
N-Benzyloxycarbonylhydroxylamine
N-Hydroxycarbamic acid benzyl ester
NSC 528506
Benzyl hydroxycarbamate
N-Cbz-hydroxylamine

Work with Benzyl N-hydroxycarbamate

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

Phenylmethyl hydrazinecarboxylate5331-43-166 % similar Benzyloxycarbonylglycine1138-80-357 % similar Phenylmethyl N-(2-amino-2-oxoethyl)carbamate949-90-657 % similar N-(Benzyloxycarbonyl)-β-alanine2304-94-154 % similar 1-[[(Phenylmethoxy)carbonyl]amino]cyclopropanecarboxylic acid84677-06-554 % similar 1,2-Bis(phenylmethyl) 1,2-diazenedicarboxylate2449-05-052 % similar Benzyl carbamate621-84-152 % similar Benzyloxycarbonyl-L-alanine1142-20-751 % similar

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

Same formula

2-(4-Nitrophenyl)ethanol100-27-6 P-Nitrophenetole100-29-8 1-Methoxy-4-methyl-2-nitrobenzene119-10-8 Glycin122-87-2 2-Methoxy-1-methyl-4-nitrobenzene13120-77-9 2,4-Dimethyl-6-nitrophenol14452-34-7 2-Nitrobenzeneethanol15121-84-3 4-Methoxy-1-methyl-2-nitrobenzene17484-36-5

Elsewhere

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