1-Aminohydantoin hydrochloride

C₃H₆ClN₃O₂CAS 2827-56-7151.55 g/mol

Open in Covalent MOL file

Primary amine

Properties

Molecular formula: C₃H₆ClN₃O₂
Molar mass: 151.55 g/mol
Exact mass: 151.0149 Da
Melting point: 202–203 °C
logP: -0.33Crippen estimate
Polar surface area: 78.9 Å²
H-bond donors / acceptors: 2 / 2
Rotatable bonds: 0

Hazards

Warning

H302 Harmful if swallowed28.6% of notifiers
H312 Harmful in contact with skin28.6% of notifiers
H315 Causes skin irritation28.6% of notifiers
H319 Causes serious eye irritation28.6% of notifiers
H332 Harmful if inhaled28.6% of notifiers
H335 May cause respiratory irritation14.3% of notifiers

Aggregated from 7 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number

2827-56-7

SMILES

Cl.NN1CC(O)=NC1=O

InChIKey

WEOHANUVLKERQI-UHFFFAOYSA-N

InChI

InChI=1S/C3H5N3O2.ClH/c4-6-1-2(7)5-3(6)8;/h1,4H2,(H,5,7,8);1H

Weigh it out

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

Names and synonyms

5 names

2,4-Imidazolidinedione, 1-amino-, hydrochloride (1:1)
Hydantoin, 1-amino-, hydrochloride
2,4-Imidazolidinedione, 1-amino-, monohydrochloride
1-Amino-2,4-imidazolidinedione monohydrochloride
1-Aminoimidazolidine-2,4-dione hydrochloride

Work with 1-Aminohydantoin 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

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.

1-Aminohydantoin6301-02-6Free base

Similar compounds

1-Methylhydantoin616-04-648 % similar Creatinine hydrochloride19230-81-041 % similar 1-(Phenylmethyl)-2,4-imidazolidinedione6777-05-539 % similar 1-Methyl-2,4,6(1H,3H,5H)-pyrimidinetrione2565-47-137 % similar Cardioxane149003-01-035 % similar Barbituric acid67-52-734 % similar Dimethylglycine hydrochloride2491-06-734 % similar Carboxymethoxylamine hemihydrochloride2921-14-434 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Elsewhere

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