chempirical

Phenprobamate

C10H13NO2CAS 673-31-4179.22 g/mol

Open in Covalent MOL file
H2NOO

Properties

Molecular formula
C10H13NO2
Molar mass
179.22 g/mol
Exact mass
179.0946 Da
Melting point
102 °C
logP
2.13Crippen estimate
Polar surface area
53.3 Ų
H-bond donors / acceptors
2 / 2
Rotatable bonds
4

Identifiers

CAS number
673-31-4
SMILES
N=C(O)OCCCc1ccccc1
InChIKey
CAMYKONBWHRPDD-UHFFFAOYSA-N
InChI
InChI=1S/C10H13NO2/c11-10(12)13-8-4-7-9-5-2-1-3-6-9/h1-3,5-6H,4,7-8H2,(H2,11,12)

Weigh it out

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

Names and synonyms

20 names · show all
  • Benzenepropanol, 1-carbamate
  • 1-Propanol, 3-phenyl-, carbamate
  • Benzenepropanol, carbamate
  • Carbamic acid, 3-phenylpropyl ester
  • MH 532
  • 3-Phenyl-1-propanol carbamate
  • Proformiphen
  • 3-Phenylpropyl carbamate
  • Extacol
  • Palmita
  • Spantol
  • Eirenal
  • Tranquil
  • γ-Phenylpropyl carbamate
  • Gamaquil
  • Ansepron
  • Quamaquil
  • NSC 44682
  • NSC 50538
  • NSC 64270

Work with Phenprobamate

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 carbamate621-84-167 % similar Felbamate25451-15-451 % similar 3-Phenylpropyl acetate122-72-549 % similar Phenyl carbamate622-46-847 % similar 2-Chloroethyl carbamate2114-18-344 % similar Benzeneacetamide103-81-142 % similar 1,3-Diphenylpropane1081-75-041 % similar Benzylurea538-32-940 % similar

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

Same formula

Methyl N,N-dimethylanthranilate10072-05-6 Dl-homophenylalanine1012-05-1 Phenibut1078-21-3 Dl-α-methylphenylalanine1132-26-9 3-Methylphenylalanine114926-37-3 3-Methyl-D-phenylalanine114926-39-5 4-((2-Hydroxyethyl)(methyl)amino)benzaldehyde1201-91-8 Propham122-42-9

Elsewhere

PubChem CAS Common Chemistry NIST WebBook