Propanedioic acid, ethyl(1-methylbutyl)-, diethyl ester


Chemical Name: Propanedioic acid, ethyl(1-methylbutyl)-, diethyl ester
CAS Number: 76-72-2
Product Number: AG005IIW(AGN-PC-004V1X)
Synonyms:
MDL No:
Molecular Formula: C12H21O4-
Molecular Weight: 229.2927

Identification/Properties


Properties
BP:
267.6°C at 760 mmHg
Storage:
Keep in dry area;2-8℃;
Computed Properties
Molecular Weight:
258.358g/mol
XLogP3:
4
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
10
Exact Mass:
258.183g/mol
Monoisotopic Mass:
258.183g/mol
Topological Polar Surface Area:
52.6A^2
Heavy Atom Count:
18
Formal Charge:
0
Complexity:
255
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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