2-(2-Cyanophenyl)-2,2-difluoroacetic Acid - CAS 1824201-60-6
Catalog: |
BB013983 |
Product Name: |
2-(2-Cyanophenyl)-2,2-difluoroacetic Acid |
CAS: |
1824201-60-6 |
Synonyms: |
2-(2-cyanophenyl)-2,2-difluoroacetic acid; 2-(2-cyanophenyl)-2,2-difluoroacetic acid |
IUPAC Name: | 2-(2-cyanophenyl)-2,2-difluoroacetic acid |
Description: | 2-(2-Cyanophenyl)-2,2-difluoroacetic Acid (CAS# 1824201-60-6 ) is a useful research chemical. |
Molecular Weight: | 197.14 |
Molecular Formula: | C9H5F2NO2 |
Canonical SMILES: | C1=CC=C(C(=C1)C#N)C(C(=O)O)(F)F |
InChI: | InChI=1S/C9H5F2NO2/c10-9(11,8(13)14)7-4-2-1-3-6(7)5-12/h1-4H,(H,13,14) |
InChI Key: | ZJVPATRQHSTMRP-UHFFFAOYSA-N |
Publication Number | Title | Priority Date |
US-2018371016-A1 | Trifluoromethylpropanamide derivatives as htra1 inhibitors | 20160304 |
US-11014963-B2 | Trifluoromethylpropanamide derivatives as HTRA1 inhibitors | 20160304 |
Complexity: | 282 |
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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