chempirical

D-Threonine

C4H9NO3CAS 632-20-2119.12 g/mol

Open in Covalent MOL file
HONH2OOH
AlcoholCarboxylic acidPrimary amine

Properties

Molecular formula
C4H9NO3
Molar mass
119.12 g/mol
Exact mass
119.0582 Da
Melting point
251–253 °C
logP
-1.22Crippen estimate
Polar surface area
83.5 Ų
H-bond donors / acceptors
3 / 3
Rotatable bonds
2
Stereocentres
S, Rin SMILES atom order

Identifiers

CAS number
632-20-2
SMILES
C[C@H](O)[C@@H](N)C(=O)O
InChIKey
AYFVYJQAPQTCCC-STHAYSLISA-N
InChI
InChI=1S/C4H9NO3/c1-2(6)3(5)4(7)8/h2-3,6H,5H2,1H3,(H,7,8)/t2-,3+/m0/s1

Weigh it out

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

Names and synonyms

5 names
  • Threonine, D-
  • (R)-Threonine
  • NSC 46702
  • (2R,3S)-2-Amino-3-hydroxybutanoic acid
  • (2R,3S)-3-Hydroxy-2-aminobutanoic acid

Work with D-Threonine

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

Same formula

(R)-3-Amino-2-(hydroxymethyl)propanoic acid1217700-75-8 4-Amino-2-hydroxybutanoic acid13477-53-7 Allothreonine144-98-9 Homoserine1927-25-9 D-Allothreonine24830-94-2 L-Allothreonine28954-12-3 4-Amino-3-hydroxybutanoic acid352-21-6 2-Methylserine5424-29-3

Elsewhere

PubChem CAS Common Chemistry NIST WebBook