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Ethyl Vinyl Sulfide

CAT: 0024-sc-486505Size: 5 mLDry Ice: NoHazardous: No
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CAT#:0024-sc-486505Size:5 mL
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CAS Number
627-50-9

Chemical Information

Ethyl Vinyl Sulfide

inactivates thioether S-methyltransferase; structure given in first source

CAS Number627-50-9
PubChem CID12320
IUPAC Nameethenylsulfanylethane
Molecular FormulaC4H8S
Molecular Weight88.17
XLogP1.7
Topological Polar Surface Area25.3
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count2
Heavy Atom Count5
Formal Charge0
Complexity24
SMILES
CCSC=C
InChI
InChI=1S/C4H8S/c1-3-5-4-2/h3H,1,4H2,2H3
InChIKey
AFGACPRTZOCNIW-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Ethyl Vinyl Sulfide
CAS: 627-50-9
CID: 12320
Formula: C4H8S
MW: 88.17
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight88.17
XLogP31.7
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count2
Exact Mass88.03467143
Monoisotopic Mass88.03467143
Topological Polar Surface Area25.3 Ų
Heavy Atom Count5
Formal Charge0
Complexity24.8
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes