Ethyl 3,3,3-trifluoro-2-(hydroxyimino)propanoate - CAS 263750-66-9
Catalog: |
BB065480 |
Product Name: |
Ethyl 3,3,3-trifluoro-2-(hydroxyimino)propanoate |
CAS: |
263750-66-9 |
Synonyms: |
ETHYL 3,3,3-TRIFLUORO-2-(HYDROXYIMINO)PROPANOATE; ethyl (2Z)-3,3,3-trifluoro-2-hydroxyiminopropanoate; ETHYL3,3,3-TRIFLUORO-2-(HYDROXYIMINO)PROPANOATE |
IUPAC Name: | ethyl (2Z)-3,3,3-trifluoro-2-hydroxyiminopropanoate |
Description: | Ethyl 3,3,3-trifluoro-2-(hydroxyimino)propanoate |
Molecular Weight: | 185.1 |
Molecular Formula: | C5H6F3NO3 |
Canonical SMILES: | CCOC(=O)C(=NO)C(F)(F)F |
InChI: | InChI=1S/C5H6F3NO3/c1-2-12-4(10)3(9-11)5(6,7)8/h11H,2H2,1H3/b9-3- |
InChI Key: | WFQNJACLNVYAIK-OQFOIZHKSA-N |
Complexity: | 199 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 1 |
Exact Mass: | 185.02997754 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 7 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 185.02997754 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 58.9Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.3 |
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