N-(3-Chlorophenyl)sulfamic acid
Basic information
- CAS
21505-85-1- Standard SMILES
O=S(=O)(O)Nc1cccc(Cl)c1- InChIKey
BSLBIQWYMQGLBL-UHFFFAOYSA-N- Molecular formula
- C6H6ClNO3S
- Average molar mass
- 207.64 g/mol
- Monoisotopic mass
- 206.9756919
Names & identifiers
- Preferred name
- N-(3-Chlorophenyl)sulfamic acid
- IUPAC
- (3-chlorophenyl)sulfamic acid
Names & synonyms
SCHEMBL27574325SCHEMBL28793582N-(3-Chlorophenyl)sulfamic acidDTXSID80135502221505-85-1
Database identifiers
- CAS
21505-85-1- PubChem CID
- 426403
- DTXSID
DTXSID801355022
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 74.8 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 236
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Compound notes
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