Benzenesulfonamide, N-(6-amino-3,5,5-trimethylhexyl)-4-methyl-
Basic information
- CAS
68479-59-4- Standard SMILES
Cc1ccc(S(=O)(=O)NCCC(C)CC(C)(C)CN)cc1- InChIKey
XSEOXXHTZJDHFY-UHFFFAOYSA-N- Molecular formula
- C16H28N2O2S
- Average molar mass
- 312.5 g/mol
- Monoisotopic mass
- 312.18714931
Names & identifiers
- Preferred name
- Benzenesulfonamide, N-(6-amino-3,5,5-trimethylhexyl)-4-methyl-
- IUPAC
- N-(6-amino-3,5,5-trimethylhexyl)-4-methylbenzenesulfonamide
- English name
- N-(6-amino-3,5,5-trimethylhexyl)-p-toluenesulphonamide
- Molecular formula
- C16H28N2O2S
- Molecular weight
- 312.47
Names & synonyms
EINECS 270-861-768479-59-4Benzenesulfonamide, N-(6-amino-3,5,5-trimethylhexyl)-4-methyl-DTXSID50887409N1-(p-Toluenesulfonyl)-3,5,5-trimethylhexamethylenediamineRefChem:563837DTXCID401026704N-(6-Amino-3,5,5-trimethylhexyl)-p-toluenesulphonamideXSEOXXHTZJDHFY-UHFFFAOYSA-NN-(6-amino-3,5,5-trimethylhexyl)-4-methylbenzene-1-sulfonamideNS00061626N-(6-Amino-3,5,5-trimethylhexyl)-4-methylbenzenesulfonamide
Database identifiers
- CAS
68479-59-4- PubChem CID
- 109403
- DTXSID
DTXSID50887409- EC Number
- 270-861-7
- Nikkaji
- J326.625G
Properties
Computed structural properties
- XLogP
- 3
- Topological polar surface area
- 80.6 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 8
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 393
Physicochemical properties
- EPA Substance Registry System
- Benzenesulfonamide, N-(6-amino-3,5,5-trimethylhexyl)-4-methyl- (68479-59-4)
- 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 InformationBenzenesulfonamide, N-(6-amino-3,5,5-trimethylhexyl)-4-methyl-: INACTIVE
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Related reactions
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Compound notes
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