Dodecanoic acid, methyl ester


Chemical Name: Dodecanoic acid, methyl ester
CAS Number: 111-82-0
Product Number: AG003S05(AGN-PC-0J7G5O)
Synonyms:
MDL No:
Molecular Formula: C13H26O2
Molecular Weight: 214.3443

Identification/Properties


Properties
MP:
4-5 °C(lit.);
BP:
263°C at 760 mmHg
Storage:
Keep in dry area;Room Temperature;
Form:
Liquid
Refractive Index:
n20/D 1.432
Solubility:
water: insoluble0.00759g/L at 25°C (practically)
Computed Properties
Molecular Weight:
214.349g/mol
XLogP3:
5.8
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
11
Exact Mass:
214.193g/mol
Monoisotopic Mass:
214.193g/mol
Topological Polar Surface Area:
26.3A^2
Heavy Atom Count:
15
Formal Charge:
0
Complexity:
144
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
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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