Methanesulfenylchloride, 1,1-dichloro-1-fluoro- supplier

Name
DICHLOROFLUOROMETHANESULFENYL CHLORIDE
EINECS 220-310-1
CAS No. 2712-93-8
Density 1.717 g/cm³
Solubility
Melting Point
Formula CCl₃FS
Boiling Point 107.5 °C at 760 mmHg
Molecular Weight 169.434
Flash Point 18.8 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms Dichloro(chlorosulfanyl)fluoromethane;
PSA 25.30000
LogP 2.93180

Methanesulfenylchloride, 1,1-dichloro-1-fluoro- Specification

The Methanesulfenylchloride, 1,1-dichloro-1-fluoro-, with the CAS registry number of 2712-93-8, is also known as Dichloro(chlorosulfanyl)fluoromethane. Its EINECS registry number is 220-310-1. Its molecular formula is CCl₃FS and molecular weight is 169.4331032. What's more, its IUPAC name is [Dichloro(fluoro)methyl] thiohypochlorite.

Physical properties about the Methanesulfenylchloride, 1,1-dichloro-1-fluoro- are: (1)ACD/LogP: 3.74; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 3.74; (4)ACD/LogD (pH 7.4): 3.74; (5)ACD/BCF (pH 5.5): 410.8; (6)ACD/BCF (pH 7.4): 410.8; (7)ACD/KOC (pH 5.5): 2584.87; (8)ACD/KOC (pH 7.4): 2584.87; (9)#H bond acceptors: 0; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 25.3 Å²; (13)Index of Refraction: 1.506; (14)Molar Refractivity: 29.35 cm³; (15)Molar Volume: 98.6 cm³; (16)Surface Tension: 36.5 dyne/cm; (17)Density: 1.717 g/cm³; (18)Flash Point: 18.8 °C; (19)Enthalpy of Vaporization: 33.2 kJ/mol; (20)Boiling Point: 107.5 °C at 760 mmHg; (21)Vapour Pressure: 31.5 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: ClC(Cl)(F)SCl
(2) InChI: InChI=1/CCl3FS/c2-1(3,5)6-4
(3) InChIKey: KDRSHFSCTSFYGH-UHFFFAOYAQ

The toxicity data is as follows:

Organism	Test Type	Route	Reported Dose (Normalized Dose)	Effect	Source
mouse	LD50	oral	840mg/kg (840mg/kg)		Chemical Abstracts. Vol. 85, Pg. 117680t, 1976.

Product Name

DICHLOROFLUOROMETHANESULFENYL CHLORIDE

Methanesulfenylchloride, 1,1-dichloro-1-fluoro- Specification

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