Basic information
- CAS
6963-36-6- Standard SMILES
Cc1cc(N)c(NC2OC(CO)C(O)C2O)cc1C.Cl- InChIKey
SWOSFQHGCFTSRW-UHFFFAOYSA-N- Molecular formula
- C13H21ClN2O4
- Average molar mass
- 304.77 g/mol
- Monoisotopic mass
- 304.1189848
Names & identifiers
- Preferred name
- 2-(2-Amino-4,5-dimethylanilino)-5-(hydroxymethyl)oxolane-3,4-diol;hydrochloride
- IUPAC
- 2-(2-amino-4,5-dimethylanilino)-5-(hydroxymethyl)oxolane-3,4-diol;hydrochloride
Names & synonyms
NSC53764NSC-537646963-36-6
Database identifiers
- CAS
6963-36-6- PubChem CID
- 54598548
Properties
Computed structural properties
- Topological polar surface area
- 108 Ų
- Hydrogen bond donors
- 6
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 3
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 304
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…