CAS
73-67-6 Purity
98%
73-67-6 Purity
98%
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2-Octenoic acid, methylester, (2E)-
CAS
7367-81-9
Catalog Number
ACM7367819
Category
Other Products
Molecular Weight
156.22
Molecular Formula
C9H16 O2
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Specification
Synonyms
Methyl oct-2-enoate, METHYL 2-OCTENOATE, Methyl trans-2-octenoate, trans-Methyl-2-octenoate, 2-Octenoic acid, methyl ester, Methyl (E)-2-octenoate, Methyl (E)-oct-2-enoate, Methyl 2-octenoate, (E)-, W371203_ALDRICH, FEMA No. 3712, 2-Octenoic acid, methyl ester, (E)-, EINECS 219-259-8, EINECS 230-912-6, NSC617617, ZINC01613340, 2-Octenoic acid, methyl ester, (Z)-, CID5364532, OR24496, 2-Octenoic acid, methyl ester, (2Z)-, 7367-81-9
IUPAC Name
methyl (E)-oct-2-enoate
SMILES
CCCCCC=CC(=O)OC
InChI Key
CJBQSBZJDJHMLF-BQYQJAHWSA-N
Boiling Point
89-91ºC9 mm Hg
Flash Point
82.8ºC
Density
0.898 g/mL at 25ºC
Appearance
COLORLESS LIQUID
EC Number
230-912-6
Exact Mass
156.11500
H-Bond Acceptor
2
H-Bond Donor
0
Safety Description
S26-S36
WGK Germany
3
Upstream Synthesis Route 1
- 922-69-0
- 66-25-1
- 7367-81-9
Reference: [1]McElvain et al.
[Journal of the American Chemical Society, 1954, vol. 76, p. 5736,3737]
Upstream Synthesis Route 2
- 67-56-1
- 628-71-7
- 201230-82-2
- 7367-81-9
Reference: [1]Murray,T.F.; Norton,J.R.
[Journal of the American Chemical Society, 1979, vol. 101, p. 4107 - 4119]
Downstream Synthesis Route 1
- 85-41-6
- 7367-81-9
- 141627-79-4
Reference: [1]Gerwick, William H.; Jiang, Zhi D.; Agarwal, Santosh K.; Farmer, Bennett T.
[Tetrahedron, 1992, vol. 48, # 12, p. 2313 - 2324]
[2]Bonnard, Isabelle; Rolland, Marc; Salmon, Jean-Marie; Debiton, Eric; Barthomeuf, Chantal; Banaigs, Bernard
[Journal of Medicinal Chemistry, 2007, vol. 50, # 6, p. 1266 - 1279]
* For details of the synthesis route, please refer to the original source to ensure accuracy.
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