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Structure

2-Heptenoic acid

CAS
18999-28-5
Catalog Number
ACM18999285
Category
Other Products
Molecular Weight
128.19
Molecular Formula
C7H12O2

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Specification

Synonyms
Hept-2-ensaeure; RARECHEM AL BK 0163; 2-HEPTENOIC ACID; HEPT-2-ENOIC ACID; 2-Heptenoic Acid (contains 3-Heptenoic Acid);
IUPAC Name
(E)-hept-2-enoic acid
Canonical SMILES
CCCCC=CC(=O)O
InChI Key
YURNCBVQZBJDAJ-AATRIKPKSA-N
Boiling Point
226.6ºC at 760 mmHg
Flash Point
133.4ºC
Density
0.968 g/cm³
Appearance
colorless to pale yellow clear liquid
EC Number
242-738-8
Exact Mass
128.08400
H-Bond Acceptor
2
H-Bond Donor
1

Upstream Synthesis Route 1

  • 22104-77-4
  • 18999-28-5
  • 2463-63-0

Reference: [1]Delaby; Guillot-Allegre
[Bulletin de la Societe Chimique de France, 1933, vol. <4>53, p. 314]
Martin; Schepartz; Daubert
[Journal of the American Chemical Society, 1948, vol. 70, p. 2601]

Upstream Synthesis Route 2

  • 2463-63-0
  • 18999-28-5

Reference: [1]Delaby; Guillot-Allegre
[Bulletin de la Societe Chimique de France, 1933, vol. <4>53, p. 314]

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