4,4-Bis(Ethoxycarbonyl)-1,2-dimethylcyclopentene - CAS 74160-66-0
Catalog: |
BB066180 |
Product Name: |
4,4-Bis(Ethoxycarbonyl)-1,2-dimethylcyclopentene |
CAS: |
74160-66-0 |
Synonyms: |
3-Cyclopentene-1,1-dicarboxylic acid, 3,4-dimethyl-, diethyl ester; Diethyl 3,4-dimethylcyclopent-3-ene-1,1-dicarboxylate; 1,2-Dimethylcyclopentene-4,4-dicarboxylic acid diethyl ester; 1,1-DIETHYL 3,4-DIMETHYLCYCLOPENT-3-ENE-1,1-DICARBOXYLATE |
IUPAC Name: | diethyl 3,4-dimethylcyclopent-3-ene-1,1-dicarboxylate |
Molecular Weight: | 240.3 |
Molecular Formula: | C13H20O4 |
Canonical SMILES: | CCOC(=O)C1(CC(=C(C1)C)C)C(=O)OCC |
InChI: | InChI=1S/C13H20O4/c1-5-16-11(14)13(12(15)17-6-2)7-9(3)10(4)8-13/h5-8H2,1-4H3 |
InChI Key: | FYOKZZNUNQUQRW-UHFFFAOYSA-N |
Complexity: | 320 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 240.13615911 |
Formal Charge: | 0 |
Heavy Atom Count: | 17 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 240.13615911 |
Rotatable Bond Count: | 6 |
Topological Polar Surface Area: | 52.6Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.7 |
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