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8-Bromooct-1-ene

CAT: 0127-OR60222Size: 5 gDry Ice: NoHazardous: No
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CAT#:0127-OR60222Size:5 g
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CAS Number
2695-48-9
Synonyms
Oct-7-en-1-yl bromide
MDL Number
MFCD00000275
Purity
98%
Smiles
BrCCCCCCC=C
Storage Conditions
Store at 2-8°C

Chemical Information

8-Bromooct-1-ene
CAS Number2695-48-9
PubChem CID75907
IUPAC Name8-bromooct-1-ene
Molecular FormulaC8H15Br
Molecular Weight191.11
XLogP3.9
Topological Polar Surface Area0
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count0
Rotatable Bond Count6
Heavy Atom Count9
Formal Charge0
Complexity59
SMILES
C=CCCCCCCBr
InChI
InChI=1S/C8H15Br/c1-2-3-4-5-6-7-8-9/h2H,1,3-8H2
InChIKey
SNMOMUYLFLGQQS-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 8-Bromooct-1-ene
CAS: 2695-48-9
CID: 75907
Formula: C8H15Br
MW: 191.11
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight191.11
XLogP33.9
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count0
Rotatable Bond Count6
Exact Mass190.03571
Monoisotopic Mass190.03571
Topological Polar Surface Area0 Ų
Heavy Atom Count9
Formal Charge0
Complexity59.6
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