Butanoic acid, 2-methyl-, ethyl ester


Chemical Name: Butanoic acid, 2-methyl-, ethyl ester
CAS Number: 7452-79-1
Product Number: AG005AT0(AGN-PC-0JKHE9)
Synonyms:
MDL No:
Molecular Formula: C7H14O2
Molecular Weight: 130.1849

Identification/Properties


Properties
MP:
-93.23°C (estimate)
BP:
133 °C(lit.)
Storage:
Keep in dry area;Room Temperature;
Form:
Liquid
Refractive Index:
n20/D 1.397(lit.)
Computed Properties
Molecular Weight:
130.187g/mol
XLogP3:
1.9
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
4
Exact Mass:
130.099g/mol
Monoisotopic Mass:
130.099g/mol
Topological Polar Surface Area:
26.3A^2
Heavy Atom Count:
9
Formal Charge:
0
Complexity:
88.9
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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