Ethyl (1R,8S,9r)-bicyclo[6.1.0]non-4-ene-9-carboxylate - CAS 79549-89-6
Catalog: |
BB036375 |
Product Name: |
Ethyl (1R,8S,9r)-bicyclo[6.1.0]non-4-ene-9-carboxylate |
CAS: |
79549-89-6 |
Synonyms: |
ethyl (1S,8R)-bicyclo[6.1.0]non-4-ene-9-carboxylate |
IUPAC Name: | ethyl (1S,4Z,8R)-bicyclo[6.1.0]non-4-ene-9-carboxylate |
Description: | Ethyl (1R,8S,9r)-bicyclo[6.1.0]non-4-ene-9-carboxylate (CAS# 79549-89-6 ) is a useful research chemical. |
Molecular Weight: | 194.27 |
Molecular Formula: | C12H18O2 |
Canonical SMILES: | CCOC(=O)C1C2C1CCC=CCC2 |
InChI: | InChI=1S/C12H18O2/c1-2-14-12(13)11-9-7-5-3-4-6-8-10(9)11/h3-4,9-11H,2,5-8H2,1H3/t9-,10+,11? |
InChI Key: | BAOUWGVQCUYLAA-ZACCUICWSA-N |
LogP: | 2.54190 |
Publication Number | Title | Priority Date |
US-2020188524-A1 | Molecular logic gates for controlled material degradation | 20160922 |
EP-2599785-A1 | Novel methods for the synthesis and purification of oligomers | 20111130 |
US-2013137861-A1 | Novel methods for the synthesis and purification of oligomers | 20111130 |
US-8889851-B2 | Methods for the synthesis and purification of oligomers | 20111130 |
EP-2522369-A1 | Pretargeting kit, method and agents used therein | 20110509 |
Complexity: | 229 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 2 |
Defined Bond Stereocenter Count: | 1 |
Exact Mass: | 194.130679813 |
Formal Charge: | 0 |
Heavy Atom Count: | 14 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 194.130679813 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 26.3 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3 |
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