ChemicalBook--->CAS DataBase List--->402-55-1

402-55-1

402-55-1 Structure

402-55-1 Structure
IdentificationBack Directory
[Name]

4-(FLUOROSULFONYL)BENZOYL CHLORIDE
[CAS]

402-55-1
[Synonyms]

4-(FLUOROSULFONYL)BENZOYL CHLORIDE
4-(fluorosulphonyl)benzoyl chloride
4-(Fluorosulfonyl)benzoic acid chloride
4-(FLUOROSULFONYL)BENZOYL CHLORIDE, TECH ., 90%
4-(Fluorosulfonyl)benzoyl chloride technical grade, 90%
[EINECS(EC#)]

206-949-9
[Molecular Formula]

C7H4ClFO3S
[MDL Number]

MFCD00007419
[MOL File]

402-55-1.mol
[Molecular Weight]

222.62
Chemical PropertiesBack Directory
[Appearance]

solid
[Melting point ]

46-48 °C(lit.)
[Boiling point ]

96-97 °C0.7 mm Hg(lit.)
[density ]

1.5278 (estimate)
[Stability:]

Stable, but hydrolyzes in water to generate acidic gas which can react with metals (and thereby generate flammable hydrogen gas). Incompatible with water, alcohols, strong bases, oxidizing agents.
[InChI]

1S/C7H4ClFO3S/c8-7(10)5-1-3-6(4-2-5)13(9,11)12/h1-4H
[InChIKey]

JMTAYFNTRRLWQG-UHFFFAOYSA-N
[SMILES]

FS(=O)(=O)c1ccc(cc1)C(Cl)=O
Hazard InformationBack Directory
[Chemical Properties]

solid
[Uses]

4-(Fluorosulfonyl)benzoyl chloride was used as reagent in the synthesis of irreversible adenosine A1 antagonist 8-cyclopentyl-3-N-[3-((3-(4-fluorosulphonyl)benzoyl)-oxy)-propyl]-1-N-propyl-xanthine.
[reaction suitability]

reaction type: click chemistry
Safety DataBack Directory
[Hazard Codes ]

C
[Risk Statements ]

34-36/37-22
[Safety Statements ]

26-27-28-36/37/39-45
[RIDADR ]

UN 3261 8/PG 2
[WGK Germany ]

3
[HazardClass ]

8
[PackingGroup ]

III
[Storage Class]

8A - Combustible corrosive hazardous materials
[Hazard Classifications]

Acute Tox. 4 Oral
Eye Dam. 1
Skin Corr. 1B
STOT SE 3
Spectrum DetailBack Directory
[Spectrum Detail]

4-(FLUOROSULFONYL)BENZOYL CHLORIDE(402-55-1)Raman
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