Basic information
- CAS
148-54-9- Standard SMILES
COc1ccccc1Nc1ccc(N)cc1S(=O)(=O)O- InChIKey
KWQMSQIIPCKLHJ-UHFFFAOYSA-N- Molecular formula
- C13H14N2O4S
- Average molar mass
- 294.33 g/mol
- Monoisotopic mass
- 294.06742811
Names & identifiers
- Preferred name
- 5-Amino-2-((2-methoxyphenyl)amino)benzenesulphonic acid
- IUPAC
- 5-amino-2-(2-methoxyanilino)benzenesulfonic acid
- English name
- 5-amino-2-[(2-methoxyphenyl)amino]benzenesulphonic acid
- Molecular formula
- C13H14N2O4S
- Molecular weight
- 294.33
Names & synonyms
148-54-95-amino-2-(2-methoxyanilino)benzenesulfonic acid5-Amino-2-((2-methoxyphenyl)amino)benzenesulphonic acid5-amino-2-[(2-methoxyphenyl)amino]benzenesulfonic acidZQ2G9XSK6VNSC-371015-AMINO-2-[(2-METHOXYPHENYL)AMINO]BENZENESULPHONIC ACIDBenzenesulfonic acid, 5-amino-2-((2-methoxyphenyl)amino)-5-Amino-2-((2-methoxyphenyl)amino)benzenesulfonic acidBenzenesulfonic acid, 5-amino-2-[(2-methoxyphenyl)amino]-NSC37101EINECS 205-716-9
Show more names
5-Amino-2-(o-anisidino)benzenesulfonic acid5-azanyl-2-[(2-methoxyphenyl)amino]benzenesulfonic acid
Benzenesulfonic acid,5-amino-2-[(2-methoxyphenyl)amino]-UNII-ZQ2G9XSK6VSCHEMBL10701757DTXSID00163861KWQMSQIIPCKLHJ-UHFFFAOYSA-NNSC 371015-Amino-2-o-anisidinobenzenesulfonic acidDS-007068
Database identifiers
- CAS
148-54-9- PubChem CID
Properties
Computed structural properties
- XLogP
- 2.1
- Topological polar surface area
- 110 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 4
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 409
Physicochemical properties
- Density
- 1.439 · 1.439±0.06 g/cm3(Predicted)
- pka
- -1.17 · -1.17±0.50(Predicted)
- FDA UNII
- 2 G9XSK6V · ZQ2G9XSK6V
Chemistry & industry
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
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