D-Valine
Properties
- Molecular formula
- C5H11NO2
- Molar mass
- 117.15 g/mol
- Exact mass
- 117.0790 Da
- Melting point
- 280 °C
- logP
- 0.05Crippen estimate
- Polar surface area
- 63.3 Ų
- H-bond donors / acceptors
- 2 / 2
- Rotatable bonds
- 2
- Stereocentres
- Rin SMILES atom order
Hazards
Warning
- H315 Causes skin irritation12.5% of notifiers
- H319 Causes serious eye irritation12.5% of notifiers
- H335 May cause respiratory irritation12.5% of notifiers
Aggregated from 8 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
640-68-6SMILES
CC(C)[C@@H](N)C(=O)OInChIKey
KZSNJWFQEVHDMF-SCSAIBSYSA-NInChI
InChI=1S/C5H11NO2/c1-3(2)4(6)5(7)8/h3-4H,6H2,1-2H3,(H,7,8)/t4-/m1/s1Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
8 names
- Valine, D-
- (R)-Valine
- D-(-)-Valine
- NSC 20654
- (-)-2-Amino-3-methylbutyric acid
- (R)-3-Methyl-2-aminobutanoic acid
- (R)-2-Amino-3-methylbutanoic acid
- (2R)-2-Amino-3-methylbutanoic acid
Work with D-Valine
Stereoisomers, salts and isotopologues
The same compound in another form: other stereochemistry, a salt or hydrate, the free acid or base, or an isotope-labelled version.
Similar compounds
(2S,3R)-(+)-2-Amino-3-hydroxy-4-methylpentanoic acid10148-71-772 % similar
(2R,3S)-(-)-2-Amino-3-hydroxy-4-methylpentanoic acid87421-23-672 % similar
Allothreonine144-98-962 % similar
D-Allothreonine24830-94-262 % similar
L-Allothreonine28954-12-362 % similar
D-Threonine632-20-262 % similar
(S)-Threonine72-19-562 % similar
(±)-Threonine80-68-262 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue.