2-Pentenedioic acid, dimethyl ester, (2E)-


Chemical Name: 2-Pentenedioic acid, dimethyl ester, (2E)-
CAS Number: 41527-39-3
Product Number: AG01BTE9(AGN-PC-0OABUK)
Synonyms:
MDL No:
Molecular Formula: C7H10O4
Molecular Weight: 158.1519

Identification/Properties


Computed Properties
Molecular Weight:
158.153g/mol
XLogP3:
0.4
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
5
Exact Mass:
158.058g/mol
Monoisotopic Mass:
158.058g/mol
Topological Polar Surface Area:
52.6A^2
Heavy Atom Count:
11
Formal Charge:
0
Complexity:
171
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
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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