1-Amino-1-cyclopropanecarboxylic acid hydrochloride

C₄H₈ClNO₂CAS 68781-13-5137.56 g/mol

Open in Covalent MOL file

Carboxylic acid Primary amine

Properties

Molecular formula: C₄H₈ClNO₂
Molar mass: 137.56 g/mol
Exact mass: 137.0244 Da
Melting point: 222 °C (decomposes)
logP: -0.02Crippen estimate
Polar surface area: 63.3 Å²
H-bond donors / acceptors: 2 / 2
Rotatable bonds: 1

Identifiers

CAS number

68781-13-5

SMILES

Cl.NC1(C(=O)O)CC1

InChIKey

WTZRHZRMLYNBRM-UHFFFAOYSA-N

InChI

InChI=1S/C4H7NO2.ClH/c5-4(1-2-4)3(6)7;/h1-2,5H2,(H,6,7);1H

Weigh it out

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

Names and synonyms

4 names

Cyclopropanecarboxylic acid, 1-amino-, hydrochloride (1:1)
Cyclopropanecarboxylic acid, 1-amino-, hydrochloride
1-Aminocyclopropanecarboxylic acid hydrochloride
1-Carboxycyclopropanaminium chloride

Work with 1-Amino-1-cyclopropanecarboxylic acid 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

1-Aminocyclopropane-1-carboxylic acid22059-21-890 % similar 1-Aminocyclobutanecarboxylic acid hydrochloride98071-16-087 % similar 1-Aminocyclobutanecarboxylic acid22264-50-274 % similar Cycloleucine52-52-874 % similar 1-Aminocyclohexanecarboxylic acid2756-85-671 % similar 3-Aminotetrahydrofuran-3-carboxylic acid125218-55-555 % similar Acpd39026-63-648 % similar trans-1-Amino-1,3-cyclopentanedicarboxylic acid39026-64-748 % similar

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

Same formula

(R)-(+)-Alpha-amino-gamma-butyrolactone hydrochloride104347-13-9 (3S)-3-Aminodihydro-2(3H)-furanone hydrochloride2185-03-7 2-Chloro-N-methoxy-N-methylacetamide67442-07-3

Elsewhere

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