Ethyl 2-Cyano-3-(2-fluorophenyl)acrylate - CAS 84186-23-2
Catalog: |
BB037142 |
Product Name: |
Ethyl 2-Cyano-3-(2-fluorophenyl)acrylate |
CAS: |
84186-23-2 |
Synonyms: |
2-cyano-3-(2-fluorophenyl)-2-propenoic acid ethyl ester; ethyl 2-cyano-3-(2-fluorophenyl)prop-2-enoate |
IUPAC Name: | ethyl (E)-2-cyano-3-(2-fluorophenyl)prop-2-enoate |
Description: | Ethyl 2-Cyano-3-(2-fluorophenyl)acrylate (CAS# 84186-23-2) is a useful research chemical. |
Molecular Weight: | 219.21 |
Molecular Formula: | C12H10FNO2 |
Canonical SMILES: | CCOC(=O)C(=CC1=CC=CC=C1F)C#N |
InChI: | InChI=1S/C12H10FNO2/c1-2-16-12(15)10(8-14)7-9-5-3-4-6-11(9)13/h3-7H,2H2,1H3 |
InChI Key: | HAYFYQCUACVOEL-UHFFFAOYSA-N |
LogP: | 2.29578 |
Publication Number | Title | Priority Date |
CA-2873295-A1 | New bicyclicpyridine derivatives | 20120824 |
EP-2888245-B1 | New bicyclicpyridine derivatives | 20120824 |
US-2015368256-A1 | New bicyclicpyridine derivatives | 20120824 |
US-9562052-B2 | Bicyclicpyridine derivatives | 20120824 |
Complexity: | 329 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 1 |
Exact Mass: | 219.06955672 |
Formal Charge: | 0 |
Heavy Atom Count: | 16 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 219.06955672 |
Rotatable Bond Count: | 4 |
Topological Polar Surface Area: | 50.1 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.5 |
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