5-(Aminosulphonyl)-2-methoxybenzoyl chloride
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Basic information
- CAS
52542-44-6- Standard SMILES
COc1ccc(S(N)(=O)=O)cc1C(=O)Cl- InChIKey
XFZMCFJADJFEBB-UHFFFAOYSA-N- Molecular formula
- C8H8ClNO4S
- Average molar mass
- 249.67 g/mol
- Monoisotopic mass
- 248.98625642
Names & identifiers
- Preferred name
- 5-(Aminosulphonyl)-2-methoxybenzoyl chloride
- IUPAC
- 2-methoxy-5-sulfamoylbenzoyl chloride
- English name
- 5-(aminosulphonyl)-2-methoxybenzoyl chloride
- Molecular formula
- C8H8ClNO4S
- Molecular weight
- 249.67
Names & synonyms
5-(Aminosulphonyl)-2-methoxybenzoyl chloride52542-44-62-methoxy-5-sulfamoylbenzoyl chlorideEINECS 257-996-7SCHEMBL7343997DTXSID502005332-methoxy-5-sulfamylbenzoyl chloride2-methoxy-5-sulfamoyl benzoyl chlorideDB-295771NS00032522Benzoyl chloride, 5-(aminosulfonyl)-2-methoxy-
Database identifiers
- CAS
52542-44-6- PubChem CID
- 104228
- DTXSID
DTXSID50200533- EC Number
- 257-996-7
- Nikkaji
- J32.733F
Properties
Computed structural propertiesFilling in
- XLogP
- 0.7
- Topological polar surface area
- 94.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 3
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 337
Related reactions
6 records
Compound notes
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