Basic information
- CAS
455-20-9- Standard SMILES
CCc1ccc(S(=O)(=O)F)cc1- InChIKey
YKTVOVMXBLLWNM-UHFFFAOYSA-N- Molecular formula
- C8H9FO2S
- Average molar mass
- 188.22 g/mol
- Monoisotopic mass
- 188.03072886
Names & identifiers
- Preferred name
- Benzenesulfonyl fluoride, 4-ethyl-
- IUPAC
- 4-ethylbenzenesulfonyl fluoride
- English name
- p-ethylbenzenesulphonyl fluoride
- Molecular formula
- C8H9FO2S
- Molecular weight
- 188.22
Names & synonyms
4-Ethylbenzenesulfonyl fluoride455-20-9Benzenesulfonyl fluoride, 4-ethyl-EINECS 207-241-2DTXSID5060017RefChem:118111DTXCID9040425p-Ethylbenzenesulphonyl fluoride4-ethylbenzene-1-sulfonyl fluorideSCHEMBL160660564-ethylbenzene-1-sulfonylfluorideYKTVOVMXBLLWNM-UHFFFAOYSA-N
Show more names
4-Ethylbenzenesulfonic acid fluoride
AAA45520MFCD11499197AKOS006323110NS00043527EN300-317901G44909Z1198321297
Database identifiers
- CAS
455-20-9- PubChem CID
- 67997
- DTXSID
DTXSID5060017- EC Number
- 207-241-2
- Nikkaji
- J196.161F
Properties
Computed structural properties
- XLogP
- 2.5
- Topological polar surface area
- 42.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 222
Physicochemical properties
- Boiling point
- 238 · 238-289 °C
- Density
- 1.23 · 1.230±0.06 g/cm3(Predicted)
- EPA Substance Registry System
- 4 · Benzenesulfonyl fluoride, 4-ethyl- (455-20-9)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 280 · P280-P305+P351+P338
- TSCA
- TSCA listed
- REACH Registrations
- Inactive
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Hazard information
Regulatory InformationREACH registered substance: p-ethylbenzenesulphonyl fluoride (EC: 207-241-2)
Safety data
- tsca
- TSCA listed
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- REACH Registrations
- Inactive
- Precautionary statements
- P280-P305+P351+P338
Chemistry & industry
Uses & manufacturing
General Manufacturing InformationBenzenesulfonyl fluoride, 4-ethyl-: INACTIVE
Upstream & downstream products
Downstream products
Suppliers3 total
南京世洲生物科技有限公司025-85563444 18351873721 · [email protected]
陕西缔都医药化工有限公司029-029-029-81148696 18161915376 · [email protected]
XIAMEN AMITY INDUSTRY AND TRADE CO., LTD.+8618950047208 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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