3-Methoxy-5-(trifluoromethyl)benzonitrile - CAS 868167-61-7
Catalog: |
BB038069 |
Product Name: |
3-Methoxy-5-(trifluoromethyl)benzonitrile |
CAS: |
868167-61-7 |
Synonyms: |
3-methoxy-5-(trifluoromethyl)benzonitrile; 3-methoxy-5-(trifluoromethyl)benzonitrile |
IUPAC Name: | 3-methoxy-5-(trifluoromethyl)benzonitrile |
Description: | 3-Methoxy-5-(trifluoromethyl)benzonitrile (CAS# 868167-61-7) is a useful research chemical. |
Molecular Weight: | 201.15 |
Molecular Formula: | C9H6F3NO |
Canonical SMILES: | COC1=CC(=CC(=C1)C(F)(F)F)C#N |
InChI: | InChI=1S/C9H6F3NO/c1-14-8-3-6(5-13)2-7(4-8)9(10,11)12/h2-4H,1H3 |
InChI Key: | DSMSXBUFGYTQPM-UHFFFAOYSA-N |
LogP: | 2.58568 |
Publication Number | Title | Priority Date |
CN-110911753-A | Non-aqueous electrolyte and lithium ion battery | 20191213 |
US-2016016916-A1 | Exo Olefin-Containing Nuclear Transport Modulators and Uses Thereof | 20130315 |
WO-2014152263-A1 | Exo olefin-containing nuclear transport modulators and uses thereof | 20130315 |
AU-2012289492-A1 | 2,3-dihydroimidazo[1,2-c] pyrimidin-5(1H)-one compounds use as Lp-PLA2 inhibitors | 20110727 |
AU-2012289492-B2 | 2,3-dihydroimidazo[1,2-c] pyrimidin-5(1H)-one compounds use as Lp-PLA2 inhibitors | 20110727 |
Complexity: | 242 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 201.0401483 |
Formal Charge: | 0 |
Heavy Atom Count: | 14 |
Hydrogen Bond Acceptor Count: | 5 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 201.0401483 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 33 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.5 |
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