trans-2-Octenoic acid Structure

trans-2-Octenoic acid

Chemical Properties

Melting point 5-6 °C (lit.)
Boiling point 154 °C/22 mmHg (lit.)
Density  0.944 g/mL at 25 °C (lit.)
FEMA  3957 | (E)-2-OCTENOIC ACID
refractive index  n20/D 1.4588(lit.)
FLAVIS Number 08.114 | 2-Octenoic acid
Flash point >230 °F
solubility  Chloroform (Slightly), Ethyl Acetate (Slightly)
form  clear liquid
pka 4.78±0.10(Predicted)
color  Colorless to Light yellow to Light orange
Odor Relatively powerful, oily-musty odor, in dilution more fruity and pleasant, but unpleasant when undiluted
Odor Type acidic
JECFA Number 1805
BRN  1721115
Stability Light Sensitive
InChI 1S/C8H14O2/c1-2-3-4-5-6-7-8(9)10/h6-7H,2-5H2,1H3,(H,9,10)/b7-6+
InChIKey CWMPPVPFLSZGCY-VOTSOKGWSA-N
SMILES CCCCC\C=C\C(O)=O
LogP 2.93
CAS DataBase Reference 1871-67-6(CAS DataBase Reference)
Substances Added to Food (formerly EAFUS) (E)-2-OCTENOIC ACID
FDA UNII C0057TJ59E
EPA Substance Registry System 2-Octenoic acid, (2E)- (1871-67-6)
UNSPSC Code 12352100
NACRES NA.22

Safety

Symbol(GHS) Corrosion (GHS05)
Signal wordDanger
Hazard statements H314
Precautionary statements P280-P303+P361+P353-P304+P340+P310-P305+P351+P338-P363-P405
Hazard Codes  C
Risk Statements  34
Safety Statements  26-27-28-36/37/39-45
RIDADR  UN 3265 8/PG 2
WGK Germany  3
HazardClass  8
PackingGroup  III
HS Code  2916199590
Storage Class 8A - Combustible corrosive hazardous materials
Hazard Classifications Eye Dam. 1
Skin Corr. 1B
NFPA 704:
0
3 0

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