4-Cyclohexylbenzene-1-sulfonamide
Basic information
- CAS
423728-71-6- Standard SMILES
NS(=O)(=O)c1ccc(C2CCCCC2)cc1- InChIKey
BVXOWKKFUMLIDX-UHFFFAOYSA-N- Molecular formula
- C12H17NO2S
- Average molar mass
- 239.34 g/mol
- Monoisotopic mass
- 239.09799996
Names & identifiers
- Preferred name
- 4-Cyclohexylbenzene-1-sulfonamide
- IUPAC
- 4-cyclohexylbenzenesulfonamide
- English name
- 4-cyclohexylbenzene-1-sulfonamide
- Molecular formula
- C12H17NO2S
- Molecular weight
- 239.33
Names & synonyms
4-cyclohexylbenzene-1-sulfonamide423728-71-6RefChem:522333102-625-54-cyclohexylbenzenesulfonamideCambridge id 5921954Oprea1_576320SCHEMBL14341830HMS1584P20YRA72871AKOS000150381CCG-301995
Show more names
Benzenesulfonamide, 4-cyclohexyl-
DB-195723CS-0243945ST45003493EN300-27001G57966SR-01000223356SR-01000223356-1Z45415654
Database identifiers
- CAS
423728-71-6- PubChem CID
- 877260
- EC Number
- 102-625-5
Properties
Computed structural properties
- XLogP
- 3.1
- Topological polar surface area
- 68.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 306
Physicochemical properties
- Melting point
- 160 · 160-160.5 °C
- Boiling point
- 402 · 402.0±38.0 °C(Predicted)
- Density
- 1.199 · 1.199±0.06 g/cm3(Predicted)
- pka
- 10.19 · 10.19±0.10(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 280 · P280-P305+P351+P338
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]
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P280-P305+P351+P338
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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