N-(2-Hydroxy-1-(hydroxymethyl)-1-methylethyl)benzenesulfonamide
Basic information
- CAS
204982-64-9- Standard SMILES
CC(CO)(CO)NS(=O)(=O)c1ccccc1- InChIKey
FXFLFZLWSZEBBU-UHFFFAOYSA-N- Molecular formula
- C10H15NO4S
- Average molar mass
- 245.3 g/mol
- Monoisotopic mass
- 245.07217913
Names & identifiers
- Preferred name
- N-(2-Hydroxy-1-(hydroxymethyl)-1-methylethyl)benzenesulfonamide
- IUPAC
- N-(1,3-dihydroxy-2-methylpropan-2-yl)benzenesulfonamide
Names & synonyms
N-(2-HYDROXY-1-(HYDROXYMETHYL)-1-METHYLETHYL)BENZENESULFONAMIDERefChem:825434657-247-8[2-hydroxy-1-(hydroxymethyl)-isopropyl](phenylsulfonyl)amineN-(1,3-dihydroxy-2-methylpropan-2-yl)benzenesulfonamideTimTec1_000952Oprea1_232566204982-64-9SCHEMBL7189479DTXSID10352183HMS1536L06AKOS017547963
Show more names
NCGC00174946-01ST012493BRD-K75844394-001-01-8
Database identifiers
- CAS
204982-64-9- PubChem CID
- 720899
- DTXSID
DTXSID10352183- EC Number
- 657-247-8
Properties
Computed structural properties
- XLogP
- -0.2
- Topological polar surface area
- 95 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 5
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 299
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Warning
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P264, P264+P265, P270, P280, P301+P317, P305+P351+P338, P330, P337+P317, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 38 reports by companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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