Basic information
- CAS
16312-81-5- Standard SMILES
CC(C)n1c(=O)[nH][nH]c1=O- InChIKey
CWMRUOCBGPHVFQ-UHFFFAOYSA-N- Molecular formula
- C5H9N3O2
- Average molar mass
- 143.14 g/mol
- Monoisotopic mass
- 143.06947654
Names & identifiers
- Preferred name
- 4-Propan-2-yl-1,2,4-triazolidine-3,5-dione
- IUPAC
- 4-propan-2-yl-1,2,4-triazolidine-3,5-dione
Names & synonyms
16312-81-5DTXSID7012463894-(Propan-2-yl)-1,2,4-triazolidine-3,5-dione4-(1-Methylethyl)-1,2,4-triazolidine-3,5-dione
Database identifiers
- CAS
16312-81-5- PubChem CID
- 12374858
- DTXSID
DTXSID701246389
Properties
Computed structural properties
- XLogP
- -0.1
- Topological polar surface area
- 61.4 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 162
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…