DL-3-Aminoisobutyric Acid

DL_3_aminoisobutyric_acid synonyms

3-Aminoisobutyric acid; 3-Aminoisobutanoate; dl-3-Amino-2-methylpropionic acid; Propanoic acid, 3-amino-2-methyl-; Isobutanoic acid, 3-amino-; alpha-Methyl-beta-alanine; 3-Amino-2-methylpropanoate; dl-.beta.-Aminoisobutyric acid


Graphical representations:


View large 3D structure

Molecular Formula: C4H9NO2

Natural Isotopic Abundance Mass: 103.11976

Mono-Isotopic Molecular Masses:

  • C12N14: 103.0633285383
  • C13N14: 107.0767478895
  • C12N15: 104.0603634315
  • C13N15: 108.0737827827

InChI string: InChI=1S/C4H9NO2/c1-3(2-5)4(6)7/h3H,2,5H2,1H3,(H,6,7)/t3-/m1/s1

PubChem Compound (CID): 64956
CAS Registry number: 144-90-1
MDL number: MFCD00008145
Beilstein Registry Number: 1720958
EC Number: 205-644-8
CAS Registry number: 144-90-1
Sigma-Aldrich: 217794_ALDRICH
ChemSpider: 58481
LipidMAPS: LMFA01100054
KEGG Compound ID: C05145
NIST Chemistry WebBook: 2880842530
NIST: 3416055009

Reference data were obtained primarily from the PubChem database.

Three dimensional molecular rendering uses Jmol.

InChI string and atom numbering calculated using ALATIS (Hesam Dashti, William M. Westler, John L. Markley, Hamid R. Eghbalnia, "Unique identifiers for small molecules enable rigorous labeling of their atoms", Scientific Data 4, Article number: 170073 (2017), doi:10.1038/sdata.2017.73, https://www.nature.com/articles/sdata201773)