Glycyl-DL-valine

C₇H₁₄N₂O₃CAS 2325-17-9174.20 g/mol

Open in Covalent MOL file

Carboxylic acid Primary amine

Properties

Molecular formula: C₇H₁₄N₂O₃
Molar mass: 174.20 g/mol
Exact mass: 174.1004 Da
Melting point: 173–174 °C
logP: 0.01Crippen estimate
Polar surface area: 95.9 Å²
H-bond donors / acceptors: 3 / 3
Rotatable bonds: 4

Hazards

Danger

H318 Causes serious eye damage100% of notifiers

Aggregated from 39 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P264+P265, P280, P305+P354+P338, P317

Identifiers

CAS number

2325-17-9

SMILES

CC(C)C(N=C(O)CN)C(=O)O

InChIKey

STKYPAFSDFAEPH-UHFFFAOYSA-N

InChI

InChI=1S/C7H14N2O3/c1-4(2)6(7(11)12)9-5(10)3-8/h4,6H,3,8H2,1-2H3,(H,9,10)(H,11,12)

Weigh it out

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

Names and synonyms

7 names

Valine, glycyl-
Valine, N-glycyl-, DL-
DL-Valine, N-glycyl-
Glycylvaline
NSC 122051
2-(2-Aminoacetamido)-3-methylbutanoic acid
2-(2-Aminoacetamido)-3-methylbutanoicacid

Work with Glycyl-DL-valine

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.

Glycyl-L-valine1963-21-9Defined stereoisomer Gly-D-val10521-49-0Defined stereoisomer

Similar compounds

Glycyl-DL-threonine27174-15-871 % similar Glycyl-threonine7093-70-171 % similar Glycyl-L-isoleucine19461-38-268 % similar N-(2-Chloroacetyl)-L-valine2279-16-566 % similar N-(2-Chloroacetyl)valine4090-17-966 % similar Glycyl-L-alanine3695-73-665 % similar N-Glycylalanine926-77-265 % similar Glycylleucine688-14-258 % similar

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

Same formula

Nε-Formyl-L-lysine1190-48-3 L-Theanine3081-61-6 1,1-Dimethylethyl N-(2-amino-2-oxoethyl)carbamate35150-09-5

Elsewhere

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