2-[(1,1-Dioxo-1,2-benzothiazol-3-yl)amino]phenol
Basic information
- CAS
314036-11-8- Standard SMILES
O=S1(=O)N=C(Nc2ccccc2O)c2ccccc21- InChIKey
ZVEMGZCIQSPWEG-UHFFFAOYSA-N- Molecular formula
- C13H10N2O3S
- Average molar mass
- 274.3 g/mol
- Monoisotopic mass
- 274.04121336
Names & identifiers
- Preferred name
- 2-[(1,1-Dioxo-1,2-benzothiazol-3-yl)amino]phenol
- IUPAC
- 2-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]phenol
- English name
- 2-(1,1-Dioxo-1H-1lambda6-benzo[d]isothiazol-3-ylamino)-phenol
- Molecular formula
- C13H10N2O3S
- Molecular weight
- 274.3
Names & synonyms
314036-11-82-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]phenol3-((2-Hydroxyphenyl)amino)benzo[d]isothiazole 1,1-dioxide2-[(1,1-DIOXIDO-1,2-BENZISOTHIAZOL-3-YL)AMINO]PHENOL2-[(1,1-dioxido-1,2-benzothiazol-3-yl)amino]phenol3-((2-Hydroxyphenyl)imino)-2,3-dihydrobenzo[d]isothiazole 1,1-dioxide3-[(2-HYDROXYPHENYL)AMINO]-1??,2-BENZOTHIAZOLE-1,1-DIONEMFCD00763415DTXSID001217171BBL003452STK131117AKOS000286673
Show more names
phenol, 2-[(1,1-dioxido-1,2-benzisothiazol-3-yl)amino]-2-(1,1-Dioxo-1H-1lambda6-benzo[d]isothiazol-3-ylamino)-phenol
VS-01336CS-0323632ST50906181AG-205/10988026F369366SR-01000400609SR-01000400609-13-((2-Hydroxyphenyl)amino)benzo[d]isothiazole1,1-dioxide
Database identifiers
- CAS
314036-11-8- PubChem CID
- 754496
- DTXSID
DTXSID001217171
Properties
Computed structural properties
- XLogP
- 1.7
- Topological polar surface area
- 87.1 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 469
Physicochemical properties
- HazardClass
- IRRITANT
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
- hazard_class
- IRRITANT
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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