Basic information
- CAS
34356-73-5- Standard SMILES
Cn1c(N)nc(O)c1N=O- InChIKey
PODSEHFCJNILGG-UHFFFAOYSA-N- Molecular formula
- C4H6N4O2
- Average molar mass
- 142.12 g/mol
- Monoisotopic mass
- 142.04907545
Names & identifiers
- Preferred name
- 4-Imidazolidinone, 5-hydroxyimino-2-imino-1-methyl-
- IUPAC
- 2-amino-1-methyl-5-nitrosoimidazol-4-ol
- English name
- 1-Methyl-2-imino-5-(hydroxyimino)imidazolidine-4-one
- Molecular weight
- 142.12
Names & synonyms
34356-73-5CREATININE-5-OXIMEBRN 01355034-Imidazolidinone, 5-hydroxyimino-2-imino-1-methyl-4-Imidazolidinone-5-oxime, 2-imino-1-methyl-2-24-00-00265 (Beilstein Handbook Reference)1-Methyl-2-imino-5-(hydroxyimino)imidazolidine-4-oneDTXSID701384262AKOS0063388792-Amino-1-methyl-5-nitrosoimidazol-4-olDB-259745Creatinine oxime
Show more names
1,5-Dihydro-5-(hydroxyimino)-2-amino-1-methyl-4H-imidazol-4-one
Database identifiers
- CAS
34356-73-5- PubChem CID
- 36799
- DTXSID
DTXSID701384262- Nikkaji
- J55.421I
Properties
Computed structural properties
- XLogP
- -0.1
- Topological polar surface area
- 93.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 0
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 141
Physicochemical properties
- Boiling point
- 303.234 · 303.234±25.00 °C(Press: 760.00 Torr)(predicted)
- Density
- 1.8 · 1.800±0.14 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted)
- pka
- 8.138 · 8.138±0.20(predicted)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…