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2-Methoxypropene

CAT: 1596-AR-P32932-01Size: 100 UnitsDry Ice: NoHazardous: No
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CAT#:1596-AR-P32932-01Size:100 Units
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CAS Number
116-11-0
Synonyms
2-methoxyprop-1-ene
Molecular Formula
C4H8O
Molecular Weight
72.11
API Name
Propene

Chemical Information

2-Methoxypropene

structure in first source

CAS Number116-11-0
PubChem CID8300
IUPAC Name2-methoxyprop-1-ene
Molecular FormulaC4H8O
Molecular Weight72.11
XLogP1.2
Topological Polar Surface Area9.2
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count1
Heavy Atom Count5
Formal Charge0
Complexity38
SMILES
CC(=C)OC
InChI
InChI=1S/C4H8O/c1-4(2)5-3/h1H2,2-3H3
InChIKey
YOWQWFMSQCOSBA-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 2-Methoxypropene
CAS: 116-11-0
CID: 8300
Formula: C4H8O
MW: 72.11
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight72.11
XLogP31.2
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count1
Exact Mass72.057514874
Monoisotopic Mass72.057514874
Topological Polar Surface Area9.2 Ų
Heavy Atom Count5
Formal Charge0
Complexity38.9
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