Basic information
- Standard SMILES
CC(C)CNC(=N)N.O=S(=O)(O)O- InChIKey
YQPOSRQDMBLAOE-UHFFFAOYSA-N- Molecular formula
- C5H15N3O4S
- Average molar mass
- 213.26 g/mol
- Monoisotopic mass
- 213.07832714
Names & identifiers
- Preferred name
- Isobutylguanidine sulfate
- IUPAC
- 2-(2-methylpropyl)guanidine;sulfuric acid
Names & synonyms
isobutylguanidine sulfateSCHEMBL10928324SCHEMBL10928332YQPOSRQDMBLAOE-UHFFFAOYSA-N
Database identifiers
- PubChem CID
- 86740354
Properties
Computed structural properties
- Topological polar surface area
- 147 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 2
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 163
Related reactions
2 records
Compound notes
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