1,3-Cyclohexanedicarboxylic acid, dimethyl ester


Chemical Name: 1,3-Cyclohexanedicarboxylic acid, dimethyl ester
CAS Number: 62638-06-6
Product Number: AG00ED1S(AGN-PC-005K8B)
Synonyms:
MDL No:
Molecular Formula: C10H16O4
Molecular Weight: 200.2316

Identification/Properties


Computed Properties
Molecular Weight:
200.234g/mol
XLogP3:
1.3
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
4
Exact Mass:
200.105g/mol
Monoisotopic Mass:
200.105g/mol
Topological Polar Surface Area:
52.6A^2
Heavy Atom Count:
14
Formal Charge:
0
Complexity:
202
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
2
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


Other Analytical Data


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