Basic information
- Standard SMILES
COC(=O)c1ccc(N)cc1OS(C)(=O)=O.Cl- InChIKey
YREYPEFOZXMDPZ-UHFFFAOYSA-N- Molecular formula
- C9H12ClNO5S
- Average molar mass
- 281.71 g/mol
Names & identifiers
- Preferred name
- Methyl 4-amino-2-methanesulfonyloxybenzoate hydrochloride
- IUPAC
- methyl 4-amino-2-methylsulfonyloxybenzoate;hydrochloride
Names & synonyms
SCHEMBL10789551YREYPEFOZXMDPZ-UHFFFAOYSA-NMethyl 4-amino-2-methanesulfonyloxybenzoate hydrochloride
Database identifiers
- PubChem CID
- 23320164
Properties
Computed structural properties
- Topological polar surface area
- 104 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 4
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 347
Related reactions
1 records
Compound notes
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