2-(Trifluoromethyl)quinoxaline - CAS 148853-42-3
Catalog: |
BB010340 |
Product Name: |
2-(Trifluoromethyl)quinoxaline |
CAS: |
148853-42-3 |
Synonyms: |
2-(trifluoromethyl)quinoxaline |
IUPAC Name: | 2-(trifluoromethyl)quinoxaline |
Description: | 2-(Trifluoromethyl)quinoxaline (CAS# 148853-42-3) is a useful research chemical. |
Molecular Weight: | 198.14 |
Molecular Formula: | C9H5F3N2 |
Canonical SMILES: | C1=CC=C2C(=C1)N=CC(=N2)C(F)(F)F |
InChI: | InChI=1S/C9H5F3N2/c10-9(11,12)8-5-13-6-3-1-2-4-7(6)14-8/h1-5H |
InChI Key: | YIQVNKFWTSLVSA-UHFFFAOYSA-N |
Appearance: | Solid |
MDL: | MFCD06656411 |
LogP: | 2.64860 |
GHS Hazard Statement: | H301 (100%): Toxic if swallowed [Danger Acute toxicity, oral] |
Precautionary Statement: | P261, P264, P270, P271, P280, P301+P310, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Danger |
Publication Number | Title | Priority Date |
WO-2020043271-A1 | Novel pyrrolidinyl amide compounds for the treatment of autoimmune disease | 20180828 |
WO-2020025517-A1 | Tlr7/8 antagonists and uses thereof | 20180731 |
EP-3830080-A1 | Tlr7/8 antagonists and uses thereof | 20180731 |
CN-108976174-A | A kind of 3- trifluoromethyl the research of quinoxalinone derivatives preparation method | 20180706 |
CN-111278825-A | Diazaspiro ROCK inhibitors | 20171103 |
Complexity: | 205 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 198.04048265 |
Formal Charge: | 0 |
Heavy Atom Count: | 14 |
Hydrogen Bond Acceptor Count: | 5 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 198.04048265 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 25.8 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.1 |
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