chempirical

Hydantoic acid

C3H6N2O3CAS 462-60-2118.09 g/mol

Open in Covalent MOL file
NH2ONHOOH
Carboxylic acid

Properties

Molecular formula
C3H6N2O3
Molar mass
118.09 g/mol
Exact mass
118.0378 Da
Melting point
179–180 °C
logP
-0.85Crippen estimate
Polar surface area
93.4 Ų
H-bond donors / acceptors
4 / 2
Rotatable bonds
2

Identifiers

CAS number
462-60-2
SMILES
N=C(O)NCC(=O)O
InChIKey
KZVRXPPUJQRGFN-UHFFFAOYSA-N
InChI
InChI=1S/C3H6N2O3/c4-3(8)5-1-2(6)7/h1H2,(H,6,7)(H3,4,5,8)

Weigh it out

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Names and synonyms

14 names · show all
  • Glycine, N-(aminocarbonyl)-
  • Glycine, N-carbamoyl-
  • N-(Aminocarbonyl)glycine
  • Ureidoacetic acid
  • Carbamoylglycine
  • Glycoluric acid
  • N-Carbamoylglycine
  • Urea, (carboxymethyl)-
  • Acetic acid, [(aminocarbonyl)amino]-
  • N-Carbamylglycine
  • N-(Carboxymethyl)urea
  • NSC 49417
  • 2-Ureidoacetic acid
  • 2-(Carbamoylamino)acetic acid

Work with Hydantoic acid

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

Iminodiacetic acid142-73-452 % similar Ethylenediaminediacetic acid5657-17-048 % similar Carbamoyl aspartic acid923-37-547 % similar Sarcosine107-97-146 % similar Carbamylglutamic acid1188-38-144 % similar Methylol urea1000-82-444 % similar Ethylurea625-52-542 % similar Guanidinopropionic acid353-09-342 % similar

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

Elsewhere

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