Methyl acetimidate hydrochloride

C₃H₈ClNOCAS 14777-27-6109.55 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₃H₈ClNO
Molar mass: 109.55 g/mol
Exact mass: 109.0294 Da
Melting point: 95–95.5 °C
logP: 1.05Crippen estimate
Polar surface area: 33.1 Å²
H-bond donors / acceptors: 1 / 2
Rotatable bonds: 0

Identifiers

CAS number

14777-27-6

SMILES

COC(C)=N.Cl

InChIKey

WHYJXXISOUGFLJ-UHFFFAOYSA-N

InChI

InChI=1S/C3H7NO.ClH/c1-3(4)5-2;/h4H,1-2H3;1H

Weigh it out

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

Names and synonyms

3 names

Ethanimidic acid, methyl ester, hydrochloride (1:1)
Acetimidic acid, methyl ester, hydrochloride
Ethanimidic acid, methyl ester, hydrochloride

Work with Methyl acetimidate 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

Ethyl acetimidate hydrochloride2208-07-348 % similar Dimethyl suberimidate dihydrochloride34490-86-346 % similar Dimethyl pimelimidate dihydrochloride58537-94-346 % similar O-Methylisourea hydrochloride5329-33-946 % similar Dimethyl adipimidate dihydrochloride14620-72-542 % similar Glycine methyl ester hydrochloride5680-79-531 % similar Methyl trichloroacetimidate2533-69-931 % similar

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

Same formula

3-Hydroxyazetidine hydrochloride18621-18-6 O-Allylhydroxylamine hydrochloride38945-21-0 Aminoacetone hydrochloride7737-17-9

Elsewhere

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