Catalog | OFC465514196 |
CAS | 465514-19-6 |
Category | Fluorinated Thiophenes |
Synonyms | {5-[1-methyl-5-(trifluoromethyl)-1H-pyrazol-3-yl]thiophen-2-yl}methanol |
MDL Number | MFCD03407368 |
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IUPAC Name | [5-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]thiophen-2-yl]methanol |
InChI | InChI=1S/C10H9F3N2OS/c1-15-9(10(11,12)13)4-7(14-15)8-3-2-6(5-16)17-8/h2-4,16H,5H2,1H3 |
InChI Key | RJIIPCWLMHMXQA-UHFFFAOYSA-N |
Isomeric SMILES | CN1C(=CC(=N1)C2=CC=C(S2)CO)C(F)(F)F |
Molecular Formula | C10H9F3N2OS |
Molecular Weight | 262.25 |
XLogP3-AA | 1.7 |
Hydrogen Bond Donor Count | 1 |
Hydrogen Bond Acceptor Count | 6 |
Rotatable Bond Count | 2 |
Exact Mass | 262.03876857 g/mol |
Monoisotopic Mass | 262.03876857 g/mol |
Topological Polar Surface Area | 66.3Ų |
Heavy Atom Count | 17 |
Formal Charge | 0 |
Complexity | 277 |
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