Basic information
- CAS
91-72-5- Standard SMILES
O=S(=O)(O)c1ccc(N(Cc2ccccc2)Cc2ccccc2)cc1- InChIKey
DHRZHJZKNWAIJE-UHFFFAOYSA-N- Molecular formula
- C20H19NO3S
- Average molar mass
- 353.4 g/mol
- Monoisotopic mass
- 353.10856464
Names & identifiers
- Preferred name
- Benzenesulfonic acid, 4-(bis(phenylmethyl)amino)-
- IUPAC
- 4-(dibenzylamino)benzenesulfonic acid
- English name
- N,N-dibenzylsulphanilic acid
- Molecular formula
- C20H19NO3S
- Molecular weight
- 353.43
Names & synonyms
Benzenesulfonic acid, 4-[bis(phenylmethyl)amino]-EINECS 202-091-4Benzenesulfonic acid, 4-(bis(phenylmethyl)amino)-RefChem:56447391-72-5N,N-DIBENZYLSULFANILIC ACID4-(dibenzylamino)benzenesulfonic acidN,N-Dibenzylsulphanilic acid4-(dibenzylamino)benzene-1-sulfonic acidN2F2XU8CGX4-[Bis(phenylmethyl)amino]benzenesulfonic acidDTXSID6059029
Show more names
Sulfanilic acid, N,N-dibenzyl-DHRZHJZKNWAIJE-UHFFFAOYSA-NNS00039406
Database identifiers
- CAS
91-72-5- PubChem CID
- 66680
- DTXSID
DTXSID6059029- UNII
- N2F2XU8CGX
- EC Number
- 202-091-4
- Nikkaji
- J182.081H
Properties
Computed structural properties
- XLogP
- 3.8
- Topological polar surface area
- 66 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 462
Physicochemical properties
- Density
- 1.301 · 1.301±0.06 g/cm3(Predicted)
- pka
- -1.18 · -1.18±0.50(Predicted)
- EPA Substance Registry System
- 4 · Benzenesulfonic acid, 4-[bis(phenylmethyl)amino]- (91-72-5)
- 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, 4-[bis(phenylmethyl)amino]-: INACTIVE
Suppliers1 total
陕西缔都医药化工有限公司029-029-81120477 17792793610 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…