Basic information
- CAS
26831-90-3- Standard SMILES
Cc1ccc(S(=O)(=O)N(CCO)CC(C)O)cc1- InChIKey
WWOVSKZHPUOOJS-UHFFFAOYSA-N- Molecular formula
- C12H19NO4S
- Average molar mass
- 273.35 g/mol
- Monoisotopic mass
- 273.10347926
Names & identifiers
- Preferred name
- N-(2-Hydroxyethyl)-N-(2-hydroxypropyl)-p-toluenesulphonamide
- IUPAC
- N-(2-hydroxyethyl)-N-(2-hydroxypropyl)-4-methylbenzenesulfonamide
- English name
- N-(2-hydroxyethyl)-N-(2-hydroxypropyl)-p-toluenesulphonamide
- Molecular formula
- C12H19NO4S
- Molecular weight
- 273.35
Names & synonyms
26831-90-3n-(2-hydroxyethyl)-n-(2-hydroxypropyl)-4-methylbenzenesulfonamideN-(2-Hydroxyethyl)-N-(2-hydroxypropyl)-p-toluenesulphonamideEINECS 248-021-6NSC163919DTXSID201166994N-(2-hydroxyethyl)-N-(2-hydroxypropyl)-4-methylbenzene-1-sulfonamideN-(2-HYDROXYETHYL)-N-(2-HYDROXYPROPYL)-P-TOLUENESULFONAMIDEAKOS024332400NSC 163919NSC-163919NS00051212
Show more names
Benzenesulfonamide, N-(2-hydroxyethyl)-N-(2-hydroxypropyl)-4-methyl-
Database identifiers
- CAS
26831-90-3- PubChem CID
- 4291
- DTXSID
DTXSID201166994- EC Number
- 248-021-6
- Nikkaji
- J249.056K
Properties
Computed structural properties
- XLogP
- 0.5
- Topological polar surface area
- 86.2 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 6
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 330
Physicochemical properties
- Melting point
- 66.2 · 66.2-68.2 °C(Solv: isopropanol (67-63-0))
- Boiling point
- 454.4 · 454.4±55.0 °C(Predicted)
- Density
- 1.264 · 1.264±0.06 g/cm3(Predicted)
- pka
- 14.29 · 14.29±0.10(Predicted)
Chemistry & industry
Upstream & downstream products
Downstream products
Suppliers1 total
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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