Home Carboxys Dimethyl bicyclo[3.2.2]nonane-1,5-dicarboxylate

Dimethyl bicyclo[3.2.2]nonane-1,5-dicarboxylate

CAS No.:
942999-92-0
Catalog Number:
AG00II1D
Molecular Formula:
C13H20O4
Molecular Weight:
240.2955
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Product Description
Catalog Number:
AG00II1D
Chemical Name:
Dimethyl bicyclo[3.2.2]nonane-1,5-dicarboxylate
CAS Number:
942999-92-0
Molecular Formula:
C13H20O4
Molecular Weight:
240.2955
IUPAC Name:
dimethyl bicyclo[3.2.2]nonane-1,5-dicarboxylate
InChI:
InChI=1S/C13H20O4/c1-16-10(14)12-4-3-5-13(8-6-12,9-7-12)11(15)17-2/h3-9H2,1-2H3
InChI Key:
BCWFWKSMCATFDC-UHFFFAOYSA-N
SMILES:
COC(=O)C12CCCC(CC1)(CC2)C(=O)OC
Properties
Complexity:
294  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
240.136g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
240.299g/mol
Monoisotopic Mass:
240.136g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
52.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8  
Properties