chempirical

Vigabatrin

C6H11NO2CAS 60643-86-9129.16 g/mol

Open in Covalent MOL file
NH2OOH
AlkeneCarboxylic acidPrimary amine

Properties

Molecular formula
C6H11NO2
Molar mass
129.16 g/mol
Exact mass
129.0790 Da
Melting point
209 °C
logP
0.36Crippen estimate
Polar surface area
63.3 Ų
H-bond donors / acceptors
2 / 2
Rotatable bonds
4

Identifiers

CAS number
60643-86-9
SMILES
C=CC(N)CCC(=O)O
InChIKey
PJDFLNIOAUIZSL-UHFFFAOYSA-N
InChI
InChI=1S/C6H11NO2/c1-2-5(7)3-4-6(8)9/h2,5H,1,3-4,7H2,(H,8,9)

Weigh it out

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

Names and synonyms

14 names · show all
  • 5-Hexenoic acid, 4-amino-
  • 5-Hexenoic acid, 4-amino-, (±)-
  • 4-Amino-5-hexenoic acid
  • (±)-γ-Vinyl GABA
  • (±)-4-Amino-5-hexenoic acid
  • RMI 71754
  • γ-Vinyl-GABA
  • MDL 71754
  • γ-Vinyl-γ-aminobutyric acid
  • Sabril
  • GVG
  • CPP 109
  • Gamma-Vinyl-GABA
  • Kigabeq

Work with Vigabatrin

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

Poly(L-glutamic acid)25513-46-647 % similar Glutamic acid56-86-047 % similar Glutamic acid617-65-247 % similar (-)-Glutamic acid6893-26-147 % similar Cypionic acid140-77-244 % similar 4-Pentenoic acid591-80-044 % similar 4-Methylpentanoic acid646-07-144 % similar Glutamic acid hydrochloride138-15-843 % similar

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

Same formula

L-Cyclopropylalanine102735-53-5 D-Cyclopropylalanine121786-39-8 4,4-Dimethoxybutanenitrile14618-78-1 N-Acetylmorpholine1696-20-4 (4S)-(-)-4-Isopropyl-2-oxazolidinone17016-83-0 (+)-Pipecolic acid1723-00-8 Dimethylacetoacetamide2044-64-6 (-)-Nipecotic acid25137-00-2

Elsewhere

PubChem CAS Common Chemistry NIST WebBook