Acetic acid, (carboxymethoxy)-, 1-(1,1-dimethylethyl) ester


Chemical Name: Acetic acid, (carboxymethoxy)-, 1-(1,1-dimethylethyl) ester
CAS Number: 120289-22-7
Product Number: AG008163(AGN-PC-000WDR)
Synonyms:
MDL No:
Molecular Formula: C8H14O5
Molecular Weight: 190.1938

Identification/Properties


Computed Properties
Molecular Weight:
190.195g/mol
XLogP3:
0.6
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
6
Exact Mass:
190.084g/mol
Monoisotopic Mass:
190.084g/mol
Topological Polar Surface Area:
72.8A^2
Heavy Atom Count:
13
Formal Charge:
0
Complexity:
191
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

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NMR Spectrum


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