Basic information
- CAS
68189-32-2- Standard SMILES
CC(=O)Nc1ccc2cc(S(=O)(=O)O)ccc2c1- InChIKey
ANUPUAXCNMXHNF-UHFFFAOYSA-N- Molecular formula
- C12H11NO4S
- Average molar mass
- 265.29 g/mol
- Monoisotopic mass
- 265.04087883
Names & identifiers
- Preferred name
- 2-Naphthalenesulfonic acid, 6-(acetylamino)-
- IUPAC
- 6-acetamidonaphthalene-2-sulfonic acid
- English name
- 6-acetamidonaphthalene-2-sulphonic acid
- Molecular formula
- C12H11NO4S
- Molecular weight
- 265.29
Names & synonyms
68189-32-22-Naphthalenesulfonic acid, 6-(acetylamino)-2-Acetamidonaphthalene-6-sulfonic acidEINECS 269-189-7DTXSID3071220RefChem:476822DTXCID20456566-acetamidonaphthalene-2-sulfonic acid6-Acetamidonaphthalene-2-sulphonic acidSCHEMBL950400SCHEMBL4653442SCHEMBL10596274
Show more names
ACITYLBRONNER'SACIDAcetyl Bronner's acidACITYL BRONNER'S ACID6-Acetamido-2-naphthalenesulfonic acid6-Acetylamino-2-naphthalenesulfonicacid6-ACETAMIDO-2-NAPHTHALENE SULPHONIC ACID6-ACETYLAMINONAPHTHALENE-2-SULFONIC ACID
2-acetaminonaphthalene-6-sulfonic acid6-acetamido-naphthalene-2-sulfonic acidNS00036468
Database identifiers
- CAS
68189-32-2- PubChem CID
- 109713
- DTXSID
DTXSID3071220- EC Number
- 269-189-7
Properties
Computed structural properties
- XLogP
- -0.2
- Topological polar surface area
- 91.9 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 414
Physicochemical properties
- Density
- 1.478 · 1.478±0.06 g/cm3(Predicted)
- pka
- 0.27 · 0.27±0.40(Predicted)
- EPA Substance Registry System
- 2 · 2-Naphthalenesulfonic acid, 6-(acetylamino)- (68189-32-2)
- TSCA
- TSCA listed
Safety & regulation
Safety data
- tsca
- TSCA listed
Chemistry & industry
Uses & manufacturing
General Manufacturing Information2-Naphthalenesulfonic acid, 6-(acetylamino)-: INACTIVE
Suppliers6 total
Suzhou ARTK Medchem Co., Ltd.+86-18168183658 · [email protected]
梯希爱（上海）化工贸易有限公司021-61109150 · [email protected]
普善实业（陕西）有限公司029-81310890 18165209495 · [email protected]
上海巍涛化工有限公司02150630626 17717886015 · [email protected]
广州市禄涞医药科技有限公司13660253774 · [email protected]
陕西缔都化学有限公司17691182729 17392216275 · [email protected]
Related reactions
3 records
Compound notes
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