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Home > Fluorides > 102206-47-3
102206-47-3 | Hydrazinecarbothioamide, 2-[[6-[3,3,3-trifluoro-2-hydroxy-2-(trifluoromethyl)propyl]-2-pyridinyl]methylene]-
CAS No: 102206-47-3 Catalog No: AG0006WT MDL No:
Product Description
Catalog Number:
AG0006WT
Chemical Name:
Hydrazinecarbothioamide, 2-[[6-[3,3,3-trifluoro-2-hydroxy-2-(trifluoromethyl)propyl]-2-pyridinyl]methylene]-
CAS Number:
102206-47-3
Molecular Formula:
C11H10F6N4OS
Molecular Weight:
360.2787
IUPAC Name:
[[6-[3,3,3-trifluoro-2-hydroxy-2-(trifluoromethyl)propyl]pyridin-2-yl]methylideneamino]thiourea
InChI:
InChI=1S/C11H10F6N4OS/c12-10(13,14)9(22,11(15,16)17)4-6-2-1-3-7(20-6)5-19-21-8(18)23/h1-3,5,22H,4H2,(H3,18,21,23)
InChI Key:
AZHYJALZUFPGFK-UHFFFAOYSA-N
SMILES:
NC(=S)NN=Cc1cccc(n1)CC(C(F)(F)F)(C(F)(F)F)O
Properties
Complexity:
439
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
360.048g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
10
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
360.278g/mol
Monoisotopic Mass:
360.048g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
116A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
2.2
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