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189078-69-1 | 3-Cyclopentene-1,3-dicarboxylic acid, 1,3-diethyl ester, (1R)-
CAS No: 189078-69-1 Catalog No: AG002HTW MDL No:
Product Description
Catalog Number:
AG002HTW
Chemical Name:
3-Cyclopentene-1,3-dicarboxylic acid, 1,3-diethyl ester, (1R)-
CAS Number:
189078-69-1
Molecular Formula:
C11H16O4
Molecular Weight:
212.2423
IUPAC Name:
diethyl (1R)-cyclopent-3-ene-1,3-dicarboxylate
InChI:
InChI=1S/C11H16O4/c1-3-14-10(12)8-5-6-9(7-8)11(13)15-4-2/h5,9H,3-4,6-7H2,1-2H3/t9-/m1/s1
InChI Key:
WNVXZAQVCGCLKN-SECBINFHSA-N
SMILES:
CCOC(=O)[C@@H]1CC=C(C1)C(=O)OCC
Properties
Complexity:
280
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
212.105g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
212.245g/mol
Monoisotopic Mass:
212.105g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
52.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
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