4,5-Dihydroxy-1-(hydroxymethyl)-3-(methoxymethyl)imidazolidin-2-one

HCID 86674

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Basic information

CAS: 18190-99-3
Standard SMILES: COCN1C(=O)N(CO)C(O)C1O
InChIKey: KGMHAIHCEYDEIV-UHFFFAOYSA-N
Molecular formula: C6H12N2O5
Average molar mass: 192.17 g/mol
Monoisotopic mass: 192.07462149

Names & identifiers

Preferred name: 4,5-Dihydroxy-1-(hydroxymethyl)-3-(methoxymethyl)imidazolidin-2-one
IUPAC: 4,5-dihydroxy-1-(hydroxymethyl)-3-(methoxymethyl)imidazolidin-2-one
English name: 4,5-dihydroxy-1-(hydroxymethyl)-3-(methoxymethyl)imidazolidin-2-one
Molecular formula: C6H12N2O5
Molecular weight: 192.16988

Names & synonyms

4,5-Dihydroxy-1-(hydroxymethyl)-3-(methoxymethyl)imidazolidin-2-one18190-99-3EINECS 242-083-8KGMHAIHCEYDEIV-UHFFFAOYSA-NSCHEMBL1520554DTXSID40939507NS000545984,5-Dihydroxy-1-hydroxymethyl-3-methoxymethyl-2-imidazolidinone

Database identifiers

CAS: 18190-99-3
PubChem CID: 86674
DTXSID: DTXSID40939507
EC Number: 242-083-8
Nikkaji: J266.053I

Properties

Computed structural properties

XLogP: -1.6
Topological polar surface area: 93.5 Å²
Hydrogen bond donors: 3
Hydrogen bond acceptors: 5
Rotatable bonds: 3
Heavy atoms: 13
Formal charge: 0
Complexity: 199

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