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CAS Number: 952709-84-1
(3-(4-(trifluoromethyl)phenyl)isothiazol-5-yl)methanol

Structure

 (3-(4-(trifluoromethyl)phenyl)isothiazol-5-yl)methanol
Name: (3-(4-(trifluoromethyl)phenyl)isothiazol-5-yl)methanol
Synonyms:
General Information
Product Number: 952709841

CAS Registry Number 952709-84-1
Name:
5-?Isothiazolemethanol, 3-?[4-?(trifluoromethyl)?phenyl]?-

 

Chemical Formula: C11H8F3NOS
Exact Mass: 259.03
Molecular Weight: 259.25
m/z: 259.03 (100.0%), 260.03 (12.8%), 261.02 (4.5%)

 

InChI:InChI=1S/C11H8F3NOS/c12-11(13,14)8-3-1-7(2-4-8)10-5-9(6-16)17-15-10/h1-5,16H,6H2

InChI Key:IQHSJIFNKIKFIV-UHFFFAOYSA-N

Canonical SMILES:C1=CC(=CC=C1C2=NSC(=C2)CO)C(F)(F)F

Specification

98%
References

U.S. Pat. Appl. Publ. (2007), US 20070244094 A1 20071018.                                  

Bioorganic & Medicinal Chemistry (2008), 16(6), 3321-3341.                                  
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