chempirical

D-2-Allylglycine hydrochloride

C5H10ClNO2CAS 108412-04-0151.59 g/mol

Open in Covalent MOL file
OOHNH2HCl
AlkeneCarboxylic acidPrimary amine

Properties

Molecular formula
C5H10ClNO2
Molar mass
151.59 g/mol
Exact mass
151.0400 Da
logP
0.40Crippen estimate
Polar surface area
63.3 Ų
H-bond donors / acceptors
2 / 2
Rotatable bonds
3
Stereocentres
Rin SMILES atom order

Identifiers

CAS number
108412-04-0
SMILES
C=CC[C@H](C(=O)O)N.Cl
InChIKey
DIDZZOWASZMNQW-PGMHMLKASA-N
InChI
InChI=1S/C5H9NO2.ClH/c1-2-3-4(6)5(7)8;/h2,4H,1,3,6H2,(H,7,8);1H/t4-;/m1./s1

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Names and synonyms

1 names
  • D-Allylglycine hydrochloride

Work with D-2-Allylglycine hydrochloride

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

Similar compounds

Allylglycine7685-44-189 % similar Cystine dihydrochloride30925-07-659 % similar L-Cystine, hydrochloride (1:?)34760-60-659 % similar DL-2,3-Diaminopropionic acid hydrochloride54897-59-556 % similar DL-2,3-Diaminopropionic acid hydrochloride6018-55-956 % similar S-Allylcysteine21593-77-156 % similar 2-(2-Propen-1-yl)propanedioic acid2583-25-755 % similar (±)-Cysteine hydrochloride10318-18-055 % similar

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

Same formula

Methyl azetidine-3-carboxylate hydrochloride100202-39-9 1-Aminocyclobutanecarboxylic acid hydrochloride98071-16-0

Elsewhere

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