2-Octenoic acid, (2E)-


Chemical Name: 2-Octenoic acid, (2E)-
CAS Number: 1871-67-6
Product Number: AG003UWP(AGN-PC-0O5MJS)
Synonyms:
MDL No:
Molecular Formula: C8H14O2
Molecular Weight: 142.19556

Identification/Properties


Properties
MP:
5-6 °C(lit.)
BP:
154 °C22 mm Hg(lit.)
Storage:
Inert atmosphere;Room Temperature;
Form:
Liquid
Refractive Index:
n20/D 1.4588(lit.)
Computed Properties
Molecular Weight:
142.198g/mol
XLogP3:
2.7
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
5
Exact Mass:
142.099g/mol
Monoisotopic Mass:
142.099g/mol
Topological Polar Surface Area:
37.3A^2
Heavy Atom Count:
10
Formal Charge:
0
Complexity:
116
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
Signal Word:
Danger
UN#:
3265
Hazard Statements:
H314
Precautionary Statements:
P264-P280-P301+P330+P331-P304+P340-P305+P351+P338-P310-P363-P403-P501
Class:
8
Packing Group:

NMR Spectrum


Other Analytical Data


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