Benzenamine sulfate
Basic information
- CAS
64275-30-5- Standard SMILES
O=S(=O)([O-])Nc1ccccc1- InChIKey
BEHLMOQXOSLGHN-UHFFFAOYSA-M- Molecular formula
- C6H6NO3S-
- Average molar mass
- 172.18 g/mol
- Monoisotopic mass
- 172.00683923
Overview
Benzenamine sulfate(1-) is an organic sulfamate oxoanion obtained by deprotonation of the sulfamate OH group of benzenamine sulfate. It is a conjugate base of a benzenamine sulfate.
Names & identifiers
- Preferred name
- Benzenamine sulfate
- IUPAC
- N-phenylsulfamate
Names & synonyms
Benzenamine sulfateN-Phenylsulfamatebenzenamine sulfate(1-)Sulfamic acid, N-phenyl-, ion(1-)64275-30-5aniline sulfate anionbenzenamine sulfate anionC06011CHEBI:3024DTXSID701300329AG-205/11956631Q27105928
Database identifiers
- CAS
64275-30-5- PubChem CID
- 440879
- DTXSID
DTXSID701300329- ChEBI
CHEBI:3024- Nikkaji
- J2.760.889B
Properties
Computed structural properties
- XLogP
- 0.4
- Topological polar surface area
- 77.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 1
- Heavy atoms
- 11
- Formal charge
- -1
- Complexity
- 187
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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