Butanedioic acid, acetyl-, dimethyl ester


Chemical Name: Butanedioic acid, acetyl-, dimethyl ester
CAS Number: 10420-33-4
Product Number: AG00382P(AGN-PC-0JLI8X)
Synonyms:
MDL No:
Molecular Formula: C8H12O5
Molecular Weight: 188.1779

Identification/Properties


Computed Properties
Molecular Weight:
188.179g/mol
XLogP3:
-0.2
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
6
Exact Mass:
188.068g/mol
Monoisotopic Mass:
188.068g/mol
Topological Polar Surface Area:
69.7A^2
Heavy Atom Count:
13
Formal Charge:
0
Complexity:
221
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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