Ethyl 2,2-Difluoro-2-(4-fluorophenyl)acetate - CAS 175543-23-4
Catalog: |
BB013149 |
Product Name: |
Ethyl 2,2-Difluoro-2-(4-fluorophenyl)acetate |
CAS: |
175543-23-4 |
Synonyms: |
2,2-difluoro-2-(4-fluorophenyl)acetic acid ethyl ester; ethyl 2,2-difluoro-2-(4-fluorophenyl)acetate |
IUPAC Name: | ethyl 2,2-difluoro-2-(4-fluorophenyl)acetate |
Description: | Ethyl 2,2-Difluoro-2-(4-fluorophenyl)acetate (CAS# 175543-23-4) is a useful research chemical. |
Molecular Weight: | 218.17 |
Molecular Formula: | C10H9F3O2 |
Canonical SMILES: | CCOC(=O)C(C1=CC=C(C=C1)F)(F)F |
InChI: | InChI=1S/C10H9F3O2/c1-2-15-9(14)10(12,13)7-3-5-8(11)6-4-7/h3-6H,2H2,1H3 |
InChI Key: | QTJOXVLRFWKBMD-UHFFFAOYSA-N |
LogP: | 2.48060 |
Publication Number | Title | Priority Date |
DK-3194403-T3 | PYRROLOPYRIMIDINE DERIVATIVES AS NR2B NMDA RECEPTOR ANTAGONISTS | 20140915 |
EP-3194403-B1 | Pyrrolopyrimidine derivatives as nr2b nmda receptor antagonists | 20140915 |
JP-2017526724-A | Pyrrolopyrimidine derivatives as NR2B NMDA receptor antagonists | 20140915 |
JP-6612331-B2 | Pyrrolopyrimidine derivatives as NR2B NMDA receptor antagonists | 20140915 |
KR-20170049602-A | Pyrrolopyrimidine derivatives as nr2b nmda receptor antagonists | 20140915 |
Complexity: | 223 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 218.05546401 |
Formal Charge: | 0 |
Heavy Atom Count: | 15 |
Hydrogen Bond Acceptor Count: | 5 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 218.05546401 |
Rotatable Bond Count: | 4 |
Topological Polar Surface Area: | 26.3 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.9 |
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