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Home > Fluorides > 338794-79-9
338794-79-9 | 5-(Hydroxymethyl)-1-{2-[3-(trifluoromethyl)phenoxy]ethyl}-1H-imidazole-2-thiol
CAS No: 338794-79-9 Catalog No: AG01FGDE MDL No:
Product Description
Catalog Number:
AG01FGDE
Chemical Name:
5-(Hydroxymethyl)-1-{2-[3-(trifluoromethyl)phenoxy]ethyl}-1H-imidazole-2-thiol
CAS Number:
338794-79-9
IUPAC Name:
4-(hydroxymethyl)-3-[2-[3-(trifluoromethyl)phenoxy]ethyl]-1H-imidazole-2-thione
InChI:
InChI=1S/C13H13F3N2O2S/c14-13(15,16)9-2-1-3-11(6-9)20-5-4-18-10(8-19)7-17-12(18)21/h1-3,6-7,19H,4-5,8H2,(H,17,21)
InChI Key:
GAZPNJRIGPWEQC-UHFFFAOYSA-N
Properties
Complexity:
415
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
318.065g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
318.314g/mol
Monoisotopic Mass:
318.065g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
76.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
Literature
| Title | Journal |
|---|---|
| Microsphere-based protease assays and screening application for lethal factor and factor Xa. | Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501 |
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