Phenyl carbamate

C7H7NO2CAS 622-46-8137.14 g/mol

Open in Covalent MOL file
NH2OO

Properties

Molecular formula
C7H7NO2
Molar mass
137.14 g/mol
Exact mass
137.0477 Da
Melting point
150 °C
logP
1.56Crippen estimate
Polar surface area
53.3 Ų
H-bond donors / acceptors
2 / 2
Rotatable bonds
1

Hazards

Warning
Irritant (GHS07)

Aggregated from the ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number
622-46-8
SMILES
N=C(O)Oc1ccccc1
InChIKey
BSCCSDNZEIHXOK-UHFFFAOYSA-N
InChI
InChI=1S/C7H7NO2/c8-7(9)10-6-4-2-1-3-5-6/h1-5H,(H2,8,9)

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Names and synonyms

3 names
  • Carbamic acid, phenyl ester
  • NSC 66509
  • O-Phenyl carbamate

Work with Phenyl 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

Benzyl carbamate621-84-150 % similar Phenprobamate673-31-447 % similar Felbamate25451-15-445 % similar Phenoxyacetamide621-88-545 % similar Diphenyl carbonate102-09-044 % similar Phenyl chlorothionoformate1005-56-740 % similar Phenyl acetate122-79-240 % similar 1,4-Diphenyl 1,4-benzenedicarboxylate1539-04-440 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

Anthranilic acid118-92-3 Benzodioxol-5-amine14268-66-7 4-Aminobenzoic acid150-13-0 3-Acetoxypyridine17747-43-2 5-Methoxypicolinaldehyde22187-96-8 Methyl picolinate2459-07-6 Methyl isonicotinate2459-09-8 4-Pyridineacetic acid28356-58-3

Elsewhere

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