Basic information
- Standard SMILES
CC(=O)[O-].NC(=[NH2+])c1cccc(CO)c1- InChIKey
ISFGHUFWTQOMQU-UHFFFAOYSA-N- Molecular formula
- C10H14N2O3
- Average molar mass
- 210.23 g/mol
Names & identifiers
- Preferred name
- 3-Hydroxymethylbenzamidinium acetate
- IUPAC
- [amino-[3-(hydroxymethyl)phenyl]methylidene]azanium acetate
Names & synonyms
ISFGHUFWTQOMQU-UHFFFAOYSA-N3-hydroxymethylbenzamidinium acetate
Database identifiers
- PubChem CID
- 67448271
Properties
Computed structural properties
- Topological polar surface area
- 112 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 167
Related reactions
4 records
Compound notes
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