Home Carboxys Dimethyl 5-oxocyclohexane-1,3-dicarboxylate

Dimethyl 5-oxocyclohexane-1,3-dicarboxylate

CAS No.:
87122-06-3
Catalog Number:
AG004TW1
Molecular Formula:
C10H14O5
Molecular Weight:
214.2152
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Product Description
Catalog Number:
AG004TW1
Chemical Name:
Dimethyl 5-oxocyclohexane-1,3-dicarboxylate
CAS Number:
87122-06-3
Molecular Formula:
C10H14O5
Molecular Weight:
214.2152
MDL Number:
MFCD26386306
IUPAC Name:
dimethyl 5-oxocyclohexane-1,3-dicarboxylate
InChI:
InChI=1S/C10H14O5/c1-14-9(12)6-3-7(10(13)15-2)5-8(11)4-6/h6-7H,3-5H2,1-2H3
InChI Key:
FDKNXVMEWVBHTC-UHFFFAOYSA-N
SMILES:
COC(=O)C1CC(CC(=O)C1)C(=O)OC
Properties
Complexity:
258  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
214.084g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
214.217g/mol
Monoisotopic Mass:
214.084g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
69.7A^2
Undefined Atom Stereocenter Count:
2  
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.2  
Properties