2-Naphthalenesulfonic acid, 7-amino-4-(((4-methylphenyl)sulfonyl)oxy)-
Basic information
- CAS
68003-33-8- Standard SMILES
Cc1ccc(S(=O)(=O)Oc2cc(S(=O)(=O)O)cc3cc(N)ccc23)cc1- InChIKey
LPDSDGMZMLAGJR-UHFFFAOYSA-N- Molecular formula
- C17H15NO6S2
- Average molar mass
- 393.4 g/mol
- Monoisotopic mass
- 393.03407955
Names & identifiers
- Preferred name
- 2-Naphthalenesulfonic acid, 7-amino-4-(((4-methylphenyl)sulfonyl)oxy)-
- IUPAC
- 7-amino-4-(4-methylphenyl)sulfonyloxynaphthalene-2-sulfonic acid
- English name
- 7-amino-4-[[(p-tolyl)sulphonyl]oxy]naphthalene-2-sulphonic acid
- Molecular formula
- C17H15NO6S2
- Molecular weight
- 393.43
Names & synonyms
EINECS 268-117-12-Naphthalenesulfonic acid, 7-amino-4-[[(4-methylphenyl)sulfonyl]oxy]-7-Amino-4-p-toluenesulfonato-2-naphthalenesulfonic acidDTXSID80709642-Naphthalenesulfonic acid, 7-amino-4-(((4-methylphenyl)sulfonyl)oxy)-RefChem:476981DTXCID404539568003-33-8LPDSDGMZMLAGJR-UHFFFAOYSA-NNS000363397-Amino-4-(((p-tolyl)sulphonyl)oxy)naphthalene-2-sulphonic acid7-Amino-4-[(4-methylbenzene-1-sulfonyl)oxy]naphthalene-2-sulfonic acid
Show more names
7-Amino-4-[[(p-tolyl)sulfonyl]oxy]naphthalene-2-sulfonic acid7-amino-4-[[(p-tolyl)sulphonyl]oxy]naphthalene-2-sulphonic acid7-Amino-4-(4-methylphenylsulfonyloxy)naphthalene-2-sulfonic acid7-Amino-4-[(4-methylphenyl)sulfonyloxy]-2-naphthalenesulfonic acid
Database identifiers
- CAS
68003-33-8- PubChem CID
- 106345
- DTXSID
DTXSID8070964- EC Number
- 268-117-1
- Nikkaji
- J29.248F
Properties
Computed structural properties
- XLogP
- 2.7
- Topological polar surface area
- 141 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 4
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 688
Physicochemical properties
- EPA Substance Registry System
- 2 · 2-Naphthalenesulfonic acid, 7-amino-4-[[(4-methylphenyl)sulfonyl]oxy]- (68003-33-8)
- 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 Information2-Naphthalenesulfonic acid, 7-amino-4-[[(4-methylphenyl)sulfonyl]oxy]-: INACTIVE
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…