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Trans-2-octen-1-ol

CAT: 0931-TYD-00594Size: 200 mgDry Ice: NoHazardous: No
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CAT#:0931-TYD-00594Size:200 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
18409-17-1
Target
Others
Related Pathways
Others
Purity
0.9946
Bioactivity
Trans-2-octen-1-ol is an unsaturated alcohol compound widely used in biochemical experiments and drug synthesis research.
Smiles
C(CCCC)/C=C/CO
Molecular Formula
C8H16O
Molecular Weight
128.21
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

2-Octen-1-ol, (2E)-

(E)-oct-2-en-1-ol is a medium-chain primary fatty alcohol that is (E)-2-octene substituted by a hydroxy group at position 1. It has a role as a flavouring agent and a fragrance. It is a primary allylic alcohol, a medium-chain primary fatty alcohol and an alkenyl alcohol.

CAS Number18409-17-1
PubChem CID5318599
IUPAC Name(E)-oct-2-en-1-ol
Molecular FormulaC8H16O
Molecular Weight128.21
XLogP2.5
Topological Polar Surface Area20.2
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count1
Rotatable Bond Count5
Heavy Atom Count9
Formal Charge0
Complexity67
SMILES
CCCCC/C=C/CO
InChI
InChI=1S/C8H16O/c1-2-3-4-5-6-7-8-9/h6-7,9H,2-5,8H2,1H3/b7-6+
InChIKey
AYQPVPFZWIQERS-VOTSOKGWSA-N
Chemical Structure
2D Structure
2D structure of 2-Octen-1-ol, (2E)-
CAS: 18409-17-1
CID: 5318599
Formula: C8H16O
MW: 128.21
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight128.21
XLogP32.5
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count1
Rotatable Bond Count5
Exact Mass128.120115130
Monoisotopic Mass128.120115130
Topological Polar Surface Area20.2 Ų
Heavy Atom Count9
Formal Charge0
Complexity67
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count1
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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