Ethyl 2-(2-fluorophenyl)-1,3-thiazole-4-carboxylate - CAS 842115-87-1
Catalog: |
BB065713 |
Product Name: |
Ethyl 2-(2-fluorophenyl)-1,3-thiazole-4-carboxylate |
CAS: |
842115-87-1 |
Synonyms: |
Ethyl 2-(2-fluorophenyl)thiazole-4-carboxylate; ethyl 2-(2-fluorophenyl)-1,3-thiazole-4-carboxylate; Ethyl2-(2-fluorophenyl)thiazole-4-carboxylate |
IUPAC Name: | ethyl 2-(2-fluorophenyl)-1,3-thiazole-4-carboxylate |
Description: | Ethyl 2-(2-fluorophenyl)-1,3-thiazole-4-carboxylate |
Molecular Weight: | 251.28 |
Molecular Formula: | C12H10FNO2S |
Canonical SMILES: | CCOC(=O)C1=CSC(=N1)C2=CC=CC=C2F |
InChI: | InChI=1S/C12H10FNO2S/c1-2-16-12(15)10-7-17-11(14-10)8-5-3-4-6-9(8)13/h3-7H,2H2,1H3 |
InChI Key: | AMNMXIMEGAQNCZ-UHFFFAOYSA-N |
Complexity: | 277 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 251.0416279 |
Formal Charge: | 0 |
Heavy Atom Count: | 17 |
Hydrogen Bond Acceptor Count: | 5 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 251.0416279 |
Rotatable Bond Count: | 4 |
Topological Polar Surface Area: | 67.4Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3.3 |
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