2-(4-Cyanophenyl)-2,2-difluoroacetic Acid - CAS 1261358-84-2
Catalog: |
BB006475 |
Product Name: |
2-(4-Cyanophenyl)-2,2-difluoroacetic Acid |
CAS: |
1261358-84-2 |
Synonyms: |
2-(4-cyanophenyl)-2,2-difluoroacetic acid; 2-(4-cyanophenyl)-2,2-difluoroacetic acid |
IUPAC Name: | 2-(4-cyanophenyl)-2,2-difluoroacetic acid |
Description: | 2-(4-Cyanophenyl)-2,2-difluoroacetic Acid (CAS# 1261358-84-2) is a useful research chemical. |
Molecular Weight: | 197.14 |
Molecular Formula: | C9H5F2NO2 |
Canonical SMILES: | C1=CC(=CC=C1C#N)C(C(=O)O)(F)F |
InChI: | InChI=1S/C9H5F2NO2/c10-9(11,8(13)14)7-3-1-6(5-12)2-4-7/h1-4H,(H,13,14) |
InChI Key: | YNJRLINCQPOYJK-UHFFFAOYSA-N |
Storage: | Sealed in dry, Room Temperature |
LogP: | 1.73468 |
Publication Number | Title | Priority Date |
WO-2021175669-A1 | Use of substituted 1,2,4-oxadiazoles for combating phytopathogenic fungi | 20200304 |
US-2020247785-A1 | IL-17 Ligands And Uses Thereof | 20190206 |
WO-2020163554-A1 | Il-17a modulators and uses thereof | 20190206 |
TW-202045481-A | Il-17a modulators and uses thereof | 20190206 |
AU-2016349662-A1 | Substituted oxadiazoles for combating phytopathogenic fungi | 20151105 |
Complexity: | 274 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 197.02883473 |
Formal Charge: | 0 |
Heavy Atom Count: | 14 |
Hydrogen Bond Acceptor Count: | 5 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 197.02883473 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 61.1 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.8 |
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