Ethyl cyclopropanecarboxylate - CAS 4606-07-9
Catalog: |
BB026068 |
Product Name: |
Ethyl cyclopropanecarboxylate |
CAS: |
4606-07-9 |
Synonyms: |
ethyl cyclopropanecarboxylate |
IUPAC Name: | ethyl cyclopropanecarboxylate |
Description: | Reagent used in the addition of cyclopropane. |
Molecular Weight: | 114.14 |
Molecular Formula: | C6H10O2 |
Canonical SMILES: | CCOC(=O)C1CC1 |
InChI: | InChI=1S/C6H10O2/c1-2-8-6(7)5-3-4-5/h5H,2-4H2,1H3 |
InChI Key: | LDDOSDVZPSGLFZ-UHFFFAOYSA-N |
Boiling Point: | 129-133 °C |
Purity: | > 97.0 % (GC) |
Density: | 0.96 g/cm3 |
Appearance: | Colorless to slight yellow liquid |
Storage: | Flammables area |
MDL: | MFCD00001282 |
LogP: | 0.95950 |
GHS Hazard Statement: | H225 (100%): Highly Flammable liquid and vapor [Danger Flammable liquids] |
Precautionary Statement: | P210, P233, P240, P241, P242, P243, P280, P303+P361+P353, P370+P378, P403+P235, and P501 |
Signal Word: | Danger |
Publication Number | Title | Priority Date |
CN-112479854-A | Green process for producing cyclopropyl formic acid | 20201208 |
WO-2021126458-A1 | Films made of polyethylene blends for improved sealing performance and mechanical properties | 20191217 |
CN-110804016-A | Diaryl quinoline derivatives against mycobacterium tuberculosis | 20191205 |
EP-3822306-A1 | Films for packaging of foodstuffs | 20191113 |
EP-3680389-A2 | Resin guardrail | 20190723 |
PMID | Publication Date | Title | Journal |
22263894 | 20120308 | Cyclooxygenase-1-selective inhibitors based on the (E)-2'-des-methyl-sulindac sulfide scaffold | Journal of medicinal chemistry |
Complexity: | 94.7 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 114.068079557 |
Formal Charge: | 0 |
Heavy Atom Count: | 8 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 114.068079557 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 26.3 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.9 |
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