(R)-(-)-Amino-3-hydroxybutanoic acid

C4H9NO3CAS 7013-07-2119.12 g/mol

Open in Covalent MOL file
NH2OHOHO
AlcoholCarboxylic acidPrimary amine

Properties

Molecular formula
C4H9NO3
Molar mass
119.12 g/mol
Exact mass
119.0582 Da
logP
-1.22Crippen estimate
Polar surface area
83.5 Ų
H-bond donors / acceptors
3 / 3
Rotatable bonds
3
Stereocentres
Rin SMILES atom order

Hazards

Warning
Irritant (GHS07)

Aggregated from the 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
7013-07-2
SMILES
C([C@H](CN)O)C(=O)O
InChIKey
YQGDEPYYFWUPGO-GSVOUGTGSA-N
InChI
InChI=1S/C4H9NO3/c5-2-3(6)1-4(7)8/h3,6H,1-2,5H2,(H,7,8)/t3-/m1/s1

Weigh it out

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

Names and synonyms

1 names
  • Gamma-Amino-beta-hydroxybutyric acid, (-)-

Work with (R)-(-)-Amino-3-hydroxybutanoic acid

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

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.

(S)-(+)-4-Amino-3-hydroxybutanoic acid7013-05-0Enantiomer 4-Amino-3-hydroxybutanoic acid924-49-2Stereo not defined 4-Amino-3-hydroxybutanoic acid352-21-6Stereo not defined

Similar compounds

3-(Aminomethyl)-5-methylhexanoic acid128013-69-448 % similar 3-(Aminomethyl)-5-methylhexanoic acid130912-52-648 % similar Pregabalin148553-50-848 % similar 1,3-Diamino-2-propanol616-29-548 % similar (R)-3-Hydroxytetradecanoic acid28715-21-147 % similar (3R,4R)-3-(Aminomethyl)-4,5-dimethylhexanoic acid313651-25-147 % similar Phenibut1078-21-346 % similar (R)-4-Amino-3-phenylbutanoic acid35568-36-646 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

(R)-3-Amino-2-(hydroxymethyl)propanoic acid1217700-75-8 4-Amino-2-hydroxybutanoic acid13477-53-7 Allothreonine144-98-9 2-Methyl-L-serine16820-18-1 Homoserine1927-25-9 Dl-O-methylserine19794-53-7 D-Allothreonine24830-94-2 L-Allothreonine28954-12-3

Elsewhere

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