Basic information
- CAS
28922-01-2- Standard SMILES
O=C(O)C1CCNC(N[N+](=O)[O-])=N1- InChIKey
HFIFDYDAFNLBCX-UHFFFAOYSA-N- Molecular formula
- C5H8N4O4
- Average molar mass
- 188.14 g/mol
- Monoisotopic mass
- 188.05455475
Overview
See other relationships...
Names & identifiers
- Preferred name
- 2-Nitramido-1,4,5,6-tetrahydropyrimidine-4-carboxylic acid
- IUPAC
- 2-nitramido-1,4,5,6-tetrahydropyrimidine-4-carboxylic acid
Database identifiers
- CAS
28922-01-2- PubChem CID
- 135890560
Properties
Computed structural properties
- XLogP
- -0.6
- Topological polar surface area
- 120 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 2
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 258
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…