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1562-34-1

Basic Information
CAS No.: 1562-34-1
Name: PHENYL VINYLSULFONATE
Article Data: 13
Molecular Structure:
Molecular Structure of 1562-34-1 (PHENYL VINYLSULFONATE)
Formula: C8H8O3S
Molecular Weight: 184.216
Synonyms: Ethylenesulfonicacid, phenyl ester;Phenyl ethenesulfonate;Phenyl ethylenesulfonate;Phenylvinylsulfonate;
Density: 1.261g/cm3
Melting Point: 38-42 °C(lit.)
Boiling Point: 44-46 °C2 mm Hg(lit.)
Flash Point: 72.6°C
Hazard Symbols:
Risk Codes: 36/37/38
Safety:
Hazard Codes Xi
Risk Statements 36/37/38
Safety Statements 26-37/39
RIDADR 1759
WGK Germany 3
8
HazardClass 8
PackingGroup III
PSA: 51.75000
LogP: 2.61950
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    PHENYL VINYLSULFONATE

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  • Phenyl vinylsulfonate

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    1562-34-1

    Phenyl vinylsulfonate

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    Phenyl vinylsulfonate is an ester. Palladium complex derived from a tetraphosphine-catalyzed Heck vinylation of phenyl vinylsulfonate was reported. Phenyl vinyl sulfonate reacts with various alkyl furan derivatives to yield the corresponding cycloadd

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Specification

The Phenyl vinylsulfonate, with the cas registry number 1562-34-1, has the systematic name and IUPAC name of phenyl ethenesulfonate. And the molecular formula of the chemical is C8H8O3S.

The characteristics of this chemical are as followings: (1)ACD/LogP: 2.03; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.03; (4)ACD/LogD (pH 7.4): 2.03; (5)ACD/BCF (pH 5.5): 20.55; (6)ACD/BCF (pH 7.4): 20.55; (7)ACD/KOC (pH 5.5): 302.97; (8)ACD/KOC (pH 7.4): 302.97; (9)#H bond acceptors: 3; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 3; (12)Polar Surface Area: 51.75 Å2; (13)Index of Refraction: 1.547; (14)Molar Refractivity: 46.33 cm3; (15)Molar Volume: 146 cm3; (16)Polarizability: 18.37×10-24cm3; (17)Surface Tension: 43.8 dyne/cm; (18)Density: 1.261 g/cm3; (19)Flash Point: 72.6 °C; (20)Enthalpy of Vaporization: 41.5 kJ/mol; (21)Boiling Point: 196.4 °C at 760 mmHg; (22)Vapour Pressure: 0.559 mmHg at 25°C.

You should be cautious while dealing with this chemical. It irritates to eyes, respiratory system and skin. Therefore, you had better take the following instructions: Wear suitable protective gloves and eye/face protection, and if in case of contacting with eyes, rinse immediately with plenty of water and seek medical advice.

Addtionally, the following datas could be converted into the molecular structure:
(1)SMILES: O=S(=O)(Oc1ccccc1)\C=C
(2)InChI: InChI=1/C8H8O3S/c1-2-12(9,10)11-8-6-4-3-5-7-8/h2-7H,1H2
(3)InChIKey: CILDJVVXNMDAGY-UHFFFAOYAN