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Vinyl Butyrate

CAT: 0572-TRC-V424200-1MGSize: 1 mgDry Ice: NoHazardous: No
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CAT#:0572-TRC-V424200-1MGSize:1 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
123-20-6
Synonyms
Vinyl Butanoate; Vinyl Butyrate; Vinyl n-Butyrate
Hazard Statement
No Data Available; UN number: UN2838; Packing Group: II
Smiles
CCCC(=O)OC=C
Molecular Formula
C6H10O2
Molecular Weight
114.14
Shipping Conditions
Room Temperature

Chemical Information

Vinyl butyrate

Vinyl butyrate, stabilized appears as a colorless liquid. Less dense than water. Vapors heavier than air. Used to make plastics and paints.

CAS Number123-20-6
PubChem CID31247
IUPAC Nameethenyl butanoate
Molecular FormulaC6H10O2
Molecular Weight114.14
XLogP1.4
Topological Polar Surface Area26.3
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count4
Heavy Atom Count8
Formal Charge0
Complexity86
SMILES
CCCC(=O)OC=C
InChI
InChI=1S/C6H10O2/c1-3-5-6(7)8-4-2/h4H,2-3,5H2,1H3
InChIKey
MEGHWIAOTJPCHQ-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Vinyl butyrate
CAS: 123-20-6
CID: 31247
Formula: C6H10O2
MW: 114.14
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight114.14
XLogP31.4
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count4
Exact Mass114.068079557
Monoisotopic Mass114.068079557
Topological Polar Surface Area26.3 Ų
Heavy Atom Count8
Formal Charge0
Complexity86.5
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

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