4-Chloro-2,3-difluoroaniline - CAS 878285-12-2
Catalog: |
BB038654 |
Product Name: |
4-Chloro-2,3-difluoroaniline |
CAS: |
878285-12-2 |
Synonyms: |
4-chloro-2,3-difluoroaniline; 4-chloro-2,3-difluoroaniline |
IUPAC Name: | 4-chloro-2,3-difluoroaniline |
Description: | 4-Chloro-2,3-difluoroaniline (CAS# 878285-12-2) is a useful research chemical. |
Molecular Weight: | 163.55 |
Molecular Formula: | C6H4ClF2N |
Canonical SMILES: | C1=CC(=C(C(=C1N)F)F)Cl |
InChI: | InChI=1S/C6H4ClF2N/c7-3-1-2-4(10)6(9)5(3)8/h1-2H,10H2 |
InChI Key: | KLAJZEMLYSDWNR-UHFFFAOYSA-N |
LogP: | 2.78160 |
Publication Number | Title | Priority Date |
WO-2019152883-A1 | Inhibitors of protein arginine deiminases | 20180202 |
EP-3746430-A1 | Inhibitors of protein arginine deiminases | 20180202 |
US-2021053975-A1 | Inhibitors of protein arginine deiminases | 20180202 |
AU-2015328414-A1 | Substituted aminopurine compounds, compositions thereof, and methods of treatment therewith | 20141006 |
AU-2015328414-B2 | Substituted aminopurine compounds, compositions thereof, and methods of treatment therewith | 20141006 |
Complexity: | 122 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 163.0000331 |
Formal Charge: | 0 |
Heavy Atom Count: | 10 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 163.0000331 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 26 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.1 |
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Amines and Anilines
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