Propanedioic acid, (1-methylethylidene)-, dimethyl ester


Chemical Name: Propanedioic acid, (1-methylethylidene)-, dimethyl ester
CAS Number: 22035-53-6
Product Number: AG00C2WT(AGN-PC-0LNOOB)
Synonyms:
MDL No: MFCD00517665
Molecular Formula: C8H12O4
Molecular Weight: 172.1785

Identification/Properties


Computed Properties
Molecular Weight:
172.18g/mol
XLogP3:
1.6
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
4
Exact Mass:
172.074g/mol
Monoisotopic Mass:
172.074g/mol
Topological Polar Surface Area:
52.6A^2
Heavy Atom Count:
12
Formal Charge:
0
Complexity:
205
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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