Hexanoic acid, 2-ethyl-, methyl ester


Chemical Name: Hexanoic acid, 2-ethyl-, methyl ester
CAS Number: 816-19-3
Product Number: AG0058DZ(AGN-PC-05W6P5)
Synonyms:
MDL No:
Molecular Formula: C9H18O2
Molecular Weight: 158.2380

Identification/Properties


Properties
BP:
82 °C(Press: 24 Torr)
Storage:
Room Temperature;Keep in dry area;
Form:
Liquid
Computed Properties
Molecular Weight:
158.241g/mol
XLogP3:
3
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
6
Exact Mass:
158.131g/mol
Monoisotopic Mass:
158.131g/mol
Topological Polar Surface Area:
26.3A^2
Heavy Atom Count:
11
Formal Charge:
0
Complexity:
110
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


NMR Spectrum


Other Analytical Data


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