Basic information
- CAS
14034-57-2- Standard SMILES
Cc1ccc(S(=O)(=O)O)cc1.Nc1ccccc1- InChIKey
HFWCMJLOMOWFJL-UHFFFAOYSA-N- Molecular formula
- C13H15NO3S
- Average molar mass
- 265.33 g/mol
- Monoisotopic mass
- 265.07726434
Names & identifiers
- Preferred name
- Benzenamine, 4-methylbenzenesulfonate (1:1)
- IUPAC
- aniline;4-methylbenzenesulfonic acid
- English name
- anilinium p-tolylsulphonate
- Molecular formula
- C7H8O3S.C6H7N
- Molecular weight
- 265.33
Names & synonyms
14034-57-2Aniline p-toluenesulfonateBenzenamine, 4-methylbenzenesulfonateBenzenamine, 4-methylbenzenesulfonate (1:1)DTXSID60884545EINECS 237-870-8RefChem:117236DTXCID901023981Anilinium p-tolylsulphonateaniline;4-methylbenzenesulfonic acidSCHEMBL51638204-Methylbenzene-1-sulfonic acid--aniline (1/1)
Show more names
121220-41-5
Database identifiers
- CAS
14034-57-2- PubChem CID
- 84165
- DTXSID
DTXSID60884545- EC Number
- 237-870-8
Properties
Computed structural properties
- Topological polar surface area
- 88.8 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 1
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 252
Physicochemical properties
- Melting point
- 238 °C · 238 °C(Solvent: Water; Ethanol)
- EPA Substance Registry System
- Aniline p-toluenesulfonate (14034-57-2)
- TSCA
- TSCA listed
Safety & regulation
Safety data
- tsca
- TSCA listed
Chemistry & industry
Uses & manufacturing
General Manufacturing InformationBenzenamine, 4-methylbenzenesulfonate (1:1): ACTIVE
Suppliers1 total
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
Related reactions
2 records
Compound notes
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