Ethyl 3-(1,4-Dioxaspiro[4.5]decan-8-yl)acrylate - CAS 1854994-34-5
Catalog: |
BB014231 |
Product Name: |
Ethyl 3-(1,4-Dioxaspiro[4.5]decan-8-yl)acrylate |
CAS: |
1854994-34-5 |
Synonyms: |
(E)-3-(1,4-dioxaspiro[4.5]decan-8-yl)-2-propenoic acid ethyl ester; ethyl (E)-3-(1,4-dioxaspiro[4.5]decan-8-yl)prop-2-enoate |
IUPAC Name: | ethyl 3-(1,4-dioxaspiro[4.5]decan-8-yl)prop-2-enoate |
Description: | Ethyl 3-(1,4-Dioxaspiro[4.5]decan-8-yl)acrylate (CAS# 1854994-34-5 ) is a useful research chemical. |
Molecular Weight: | 240.30 |
Molecular Formula: | C13H20O4 |
Canonical SMILES: | CCOC(=O)C=CC1CCC2(CC1)OCCO2 |
InChI: | InChI=1S/C13H20O4/c1-2-15-12(14)4-3-11-5-7-13(8-6-11)16-9-10-17-13/h3-4,11H,2,5-10H2,1H3/b4-3+ |
InChI Key: | LBCIUUCNJXGWHX-ONEGZZNKSA-N |
Publication Number | Title | Priority Date |
WO-2013157792-A1 | Bicyclic heteroaryl derivative and pharmaceutical composition comprising same | 20120417 |
EP-2257527-A1 | Substituted sulfonamide derivatives | 20080317 |
US-2009253669-A1 | Substituted Sulfonamide Compounds | 20080317 |
WO-2009115257-A1 | Substituted sulfonamide derivatives | 20080317 |
Complexity: | 282 |
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: | 4 |
Topological Polar Surface Area: | 44.8 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 1 |
XLogP3: | 1.7 |
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