Ethyl cyclohexenecarboxylate - CAS 1617-22-7
Catalog: |
BB044127 |
Product Name: |
Ethyl cyclohexenecarboxylate |
CAS: |
1617-22-7 |
Synonyms: |
ethyl cyclohex-1-ene-1-carboxylate; 1-Cyclohexene-1-carboxylic acid, ethyl ester |
IUPAC Name: | ethyl cyclohexene-1-carboxylate |
Description: | Ethyl cyclohexenecarboxylate (CAS# 1617-22-7 ) is a useful research chemical. |
Molecular Weight: | 154.21 |
Molecular Formula: | C9H14O2 |
Canonical SMILES: | CCOC(=O)C1=CCCCC1 |
InChI: | InChI=1S/C9H14O2/c1-2-11-9(10)8-6-4-3-5-7-8/h6H,2-5,7H2,1H3 |
InChI Key: | HDKVSEUEUWKMFS-UHFFFAOYSA-N |
Complexity: | 170 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 154.099379685 |
Formal Charge: | 0 |
Heavy Atom Count: | 11 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 154.099379685 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 26.3 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.4 |
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