4-Chloro-N-2-propen-1-ylbenzenesulfonamide
Basic information
- CAS
830-42-2- Standard SMILES
C=CCNS(=O)(=O)c1ccc(Cl)cc1- InChIKey
JQAXQIZINTXLFH-UHFFFAOYSA-N- Molecular formula
- C9H10ClNO2S
- Average molar mass
- 231.7 g/mol
- Monoisotopic mass
- 231.0120774
Names & identifiers
- Preferred name
- 4-Chloro-N-2-propen-1-ylbenzenesulfonamide
- IUPAC
- 4-chloro-N-prop-2-enylbenzenesulfonamide
- English name
- N-allyl-4-chlorobenzenesulfonamide
- Molecular formula
- C9H10ClNO2S
- Molecular weight
- 231.7
Names & synonyms
830-42-24-Chloro-N-2-propen-1-ylbenzenesulfonamideRefChem:292055N-allyl-4-chlorobenzenesulfonamide4-chloro-N-(prop-2-en-1-yl)benzene-1-sulfonamide4-chloro-N-prop-2-enylbenzenesulfonamidestarbld0047888N-allyl-p-chlorobenzenesulfonamideDTXSID201266112N-allyl-4-chloro-benzenesulfonamideAKOS001059980[(4-chlorophenyl)sulfonyl]prop-2-enylamine
Show more names
Benzenesulfonamide, 4-chloro-N-2-propen-1-yl-
CS-0220065ST50810964EN300-05662G47311AP-263/12086602F642876Z45529906F3386-2383
Database identifiers
- CAS
830-42-2- PubChem CID
- 2437238
- DTXSID
DTXSID201266112
Properties
Computed structural properties
- XLogP
- 2.2
- Topological polar surface area
- 54.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 276
Physicochemical properties
- Melting point
- 55 · 55.0-56.5 °C
- Boiling point
- 340.5 · 340.5±52.0 °C(Predicted)
- Density
- 1.286 · 1.286±0.06 g/cm3(Predicted)
- pka
- 10.34 · 10.34±0.50(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.
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P280-P305+P351+P338
Chemistry & industry
Upstream & downstream products
Downstream products
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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