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4-Methyl-1-pentene

CAT: 0024-sc-238897Size: 25 gDry Ice: NoHazardous: No
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CAT#:0024-sc-238897Size:25 g
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CAS Number
691-37-2

Chemical Information

4-Methyl-1-pentene

4-Methyl-1-pentene is a hydrocarbon.

CAS Number691-37-2
PubChem CID12724
IUPAC Name4-methylpent-1-ene
Molecular FormulaC6H12
Molecular Weight84.16
XLogP2.7
Topological Polar Surface Area0
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count0
Rotatable Bond Count2
Heavy Atom Count6
Formal Charge0
Complexity35
SMILES
CC(C)CC=C
InChI
InChI=1S/C6H12/c1-4-5-6(2)3/h4,6H,1,5H2,2-3H3
InChIKey
WSSSPWUEQFSQQG-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 4-Methyl-1-pentene
CAS: 691-37-2
CID: 12724
Formula: C6H12
MW: 84.16
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight84.16
XLogP32.7
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count0
Rotatable Bond Count2
Exact Mass84.093900383
Monoisotopic Mass84.093900383
Topological Polar Surface Area0 Ų
Heavy Atom Count6
Formal Charge0
Complexity35.3
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