461-28-9

461-28-9 structure

Name: 3-Fluoropropane-1-sulfonyl chloride
Chemical Name: 1-chlorosulfinyloxy-3-fluoropropane
CAS Number: 461-28-9
Molecular Formula: C₃H₆ClFO₂S
Molecular Weight: 160.59500
Create Date: 2018-05-17 08:00:00
Modify Date: 2024-01-07 13:42:27

Name	1-chlorosulfinyloxy-3-fluoropropane
Synonyms	3-fluoropropyl sulfurochloridoite 3-fluoropropanesulfonyl chloride 3-fluoropropylsulfonyl chloride 3-Fluor-propan-1-sulfonylchlorid 3-Fluoropropanesulphonyl chloride 3-fluoro-propane-1-sulfonyl chloride Propanesulfonyl chloride,3-fluoro

Density	1.449g/cm3
Boiling Point	221ºC at 760 mmHg
Molecular Formula	C₃H₆ClFO₂S
Molecular Weight	160.59500
Flash Point	87.4ºC
Exact Mass	159.97600
PSA	45.51000
LogP	2.04580
Vapour Pressure	0.163mmHg at 25°C
Index of Refraction	1.481

CHEMICAL IDENTIFICATION

RTECS NUMBER :: TZ6700000

CHEMICAL NAME :: Propanesulfonyl chloride, 3-fluoro-

CAS REGISTRY NUMBER :: 461-28-9

BEILSTEIN REFERENCE NO. :: 1753861

LAST UPDATED :: 199612

DATA ITEMS CITED :: 1

MOLECULAR FORMULA :: C3-H6-Cl-F-O2-S

MOLECULAR WEIGHT :: 160.60

WISWESSER LINE NOTATION :: OSGO3F

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :: LD50 - Lethal dose, 50 percent kill

ROUTE OF EXPOSURE :: Intraperitoneal

SPECIES OBSERVED :: Rodent - mouse

DOSE/DURATION :: 64 mg/kg

TOXIC EFFECTS :: Details of toxic effects not reported other than lethal dose value

REFERENCE :: JACSAT Journal of the American Chemical Society. (American Chemical Soc., Distribution Office Dept. 223, POB 57136, West End Stn., Washington, DC 20037) V.1- 1879- Volume(issue)/page/year: 78,3846,1956

1033906-64-7

461-28-9

Literature: BRISTOL-MYERS SQUIBB COMPANY Patent: WO2009/67108 A1, 2009 ; Location in patent: Page/Page column 133-134 ; WO 2009/067108 A1

408-00-4

~31%

461-28-9

Literature: Loeser, Reik; Fischer, Steffen; Hiller, Achim; Koeckerling, Martin; Funke, Uta; Maisonial, Aurelie; Brust, Peter; Steinbach, Joerg Beilstein Journal of Organic Chemistry, 2013 , vol. 9, p. 1002 - 1011

Precursor 2
1033906-64-7 408-00-4
DownStream 1
461-29-0

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