Benzenesulfonic acid, 5-amino-2-(2-phenylethenyl)-
Basic information
- CAS
6265-01-6- Standard SMILES
Nc1ccc(C=Cc2ccccc2)c(S(=O)(=O)O)c1- InChIKey
QBHYFEWQILVXEN-UHFFFAOYSA-N- Molecular formula
- C14H13NO3S
- Average molar mass
- 275.32 g/mol
- Monoisotopic mass
- 275.06161445
Names & identifiers
- Preferred name
- Benzenesulfonic acid, 5-amino-2-(2-phenylethenyl)-
- IUPAC
- 5-amino-2-(2-phenylethenyl)benzenesulfonic acid
- English name
- 4-aminostilbene-2-sulphonic acid
- Molecular formula
- C14H13NO3S
- Molecular weight
- 275.32292
Names & synonyms
6265-01-6Benzenesulfonic acid, 5-amino-2-(2-phenylethenyl)-DTXSID4064183EINECS 228-429-0RefChem:564704DTXCID7043455SCHEMBL5751201QBHYFEWQILVXEN-UHFFFAOYSA-N4-amino-2-stilbenesulfonic acid4-aminostilbene-2-sulphonic acid5-Amino-2-(2-phenylethenyl)benzenesulfonic acid
Database identifiers
- CAS
6265-01-6- PubChem CID
- 111181
- DTXSID
DTXSID4064183- EC Number
- 228-429-0
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 88.8 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 407
Physicochemical properties
- Density
- 1.392 · 1.392±0.06 g/cm3(Predicted)
- pka
- -0.95 · -0.95±0.42(Predicted)
- EPA Substance Registry System
- 5 · Benzenesulfonic acid, 5-amino-2-(2-phenylethenyl)- (6265-01-6)
- TSCA
- TSCA listed
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- tsca
- TSCA listed
Chemistry & industry
Uses & manufacturing
General Manufacturing InformationBenzenesulfonic acid, 5-amino-2-(2-phenylethenyl)-: INACTIVE
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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