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Methyl (E) -oct-2-enoate

CAT: 0804-HY-W039379-01Size: 1 gDry Ice: NoHazardous: No
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CAT#:0804-HY-W039379-01Size:1 g
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Description
Methyl (E) -oct-2-enoate is commonly used as an ingredient in perfume, cologne, and food flavor in the perfume and fragrance industry. Its pleasant fragrance and low volatility make it a good choice for adding fruit to various products. A popular choice for incense, in addition to its application in the fragrance and fragrance industry, Methyl (E) -oct-2-enoate is also used as a raw material for the synthesis of other organic compounds, it can be oxidized to form methyl 3-oxobutyrate, Used in the production of pharmaceuticals and agrochemicals. Overall, Methyl (E) -oct-2-enoate is a versatile compound that is used in various industries for its pleasant aroma and reactivity, its fruity and floral notes in fragrances and essences Industry is highly sought after, and its ability to serve as a starting material for other compounds makes it useful in organic synthesis.
CAS Number
7367-81-9
Product Name Alternative
Trans-2-Octenoic acid methyl ester
UNSPSC
12352200
Hazard Statement
H227, H302
Target
Biochemical Assay Reagents
Type
Biochemical Assay Reagents
Related Pathways
Others
Field of Research
Others
Assay Protocol
https://www.medchemexpress.com/methyl-e-oct-2-enoate.html
Purity
98.02
Solubility
DMSO : 200 mg/mL
Smiles
CCCCC/C=C/C(OC)=O
Molecular Formula
C9H16O2
Molecular Weight
156.22
Precautions
H227, H302
Shipping Conditions
Room Temperature
Storage Conditions
Store at room temperature 3 years
Scientific Category
Biochemical Assay Reagents
Clinical Information
No Development Reported

Chemical Information

Methyl oct-2-enoate

Methyl 2-octenoate is a fatty acid ester.

CAS Number7367-81-9
PubChem CID5364532
IUPAC Namemethyl (E)-oct-2-enoate
Molecular FormulaC9H16O2
Molecular Weight156.22
XLogP3
Topological Polar Surface Area26.3
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count6
Heavy Atom Count11
Formal Charge0
Complexity128
SMILES
CCCCC/C=C/C(=O)OC
InChI
InChI=1S/C9H16O2/c1-3-4-5-6-7-8-9(10)11-2/h7-8H,3-6H2,1-2H3/b8-7+
InChIKey
CJBQSBZJDJHMLF-BQYQJAHWSA-N
Chemical Structure
2D Structure
2D structure of Methyl oct-2-enoate
CAS: 7367-81-9
CID: 5364532
Formula: C9H16O2
MW: 156.22
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight156.22
XLogP33
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count6
Exact Mass156.115029749
Monoisotopic Mass156.115029749
Topological Polar Surface Area26.3 Ų
Heavy Atom Count11
Formal Charge0
Complexity128
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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