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CAS No.: | 26750-50-5 |
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Name: | Bis(vinylsulfonylmethyl) ether |
Molecular Structure: | |
Formula: | C6H10O5S2 |
Molecular Weight: | 226.274 |
Synonyms: | 1,1'-(Oxybis(methylenesulfonyl))bisethene; |
EINECS: | 247-958-8 |
Density: | 1.362 g/cm3 |
Melting Point: | 41.5-42.5 °C |
Boiling Point: | 478.8 °C at 760 mmHg |
Flash Point: | 243.4 °C |
PSA: | 94.27000 |
LogP: | 2.19620 |
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The CAS register number of Bis(vinylsulfonylmethyl) ether is 26750-50-5. It also can be called as 1,1'-(Oxybis(methylenesulfonyl))bisethene and the IUPAC name about this chemical is 1-(ethenylsulfonylmethoxymethylsulfonyl)ethene. The molecular formula about this chemical is C6H10O5S2 and molecular weight is 226.26. It belongs to the Pharmaceutical Intermediates.
Physical properties about Bis(vinylsulfonylmethyl) ether are:(1)ACD/LogP: -0.05; (2)ACD/LogD (pH 5.5): -0.05; (3)ACD/LogD (pH 7.4): -0.05; (4)ACD/BCF (pH 5.5): 1; (5)ACD/BCF (pH 7.4): 1; (6)ACD/KOC (pH 5.5): 22.37; (7)ACD/KOC (pH 7.4): 22.37; (8)#H bond acceptors: 5; (9)#Freely Rotating Bonds: 6; (10)Polar Surface Area: 94.27Å2; (11)Index of Refraction: 1.498; (12)Molar Refractivity: 48.73 cm3; (13)Molar Volume: 166.1 cm3; (14)Polarizability: 19.32x10-24cm3; (15)Surface Tension: 46.8 dyne/cm; (16)Enthalpy of Vaporization: 71.46 kJ/mol; (17)Boiling Point: 478.8 °C at 760 mmHg; (18)Vapour Pressure: 7.23E-09 mmHg at 25°C .
You can still convert the following datas into molecular structure:
(1)SMILES: O=S(=O)(\C=C)COCS(=O)(=O)/C=C
(2)InChI: InChI=1/C6H10O5S2/c1-3-12(7,8)5-11-6-13(9,10)4-2/h3-4H,1-2,5-6H2
(3)InChIKey: KAMCBFNNGGVPPW-UHFFFAOYAQ
(4)Std. InChI: InChI=1S/C6H10O5S2/c1-3-12(7,8)5-11-6-13(9,10)4-2/h3-4H,1-2,5-6H2
(5)Std. InChIKey: KAMCBFNNGGVPPW-UHFFFAOYSA-N
The toxicity data is as follows:
Organism | Test Type | Route | Reported Dose (Normalized Dose) | Effect | Source |
---|---|---|---|---|---|
mouse | LD50 | intraperitoneal | 1mg/kg (1mg/kg) | BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY) LUNGS, THORAX, OR RESPIRATION: CYANOSIS SKIN AND APPENDAGES (SKIN): HAIR: OTHER | National Technical Information Service. Vol. OTS0534326, |
mouse | LD50 | oral | 50mg/kg (50mg/kg) | BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY) LUNGS, THORAX, OR RESPIRATION: CYANOSIS SKIN AND APPENDAGES (SKIN): HAIR: OTHER | National Technical Information Service. Vol. OTS0534326, |
rat | LD50 | intraperitoneal | 1mg/kg (1mg/kg) | BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY) VASCULAR: REGIONAL OR GENERAL ARTERIOLAR OR VENOUS DILATION LUNGS, THORAX, OR RESPIRATION: CYANOSIS | National Technical Information Service. Vol. OTS0534326, |
rat | LD50 | oral | 50mg/kg (50mg/kg) | GASTROINTESTINAL: "HYPERMOTILITY, DIARRHEA" BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY) LUNGS, THORAX, OR RESPIRATION: CYANOSIS | National Technical Information Service. Vol. OTS0534326, |