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206761-90-2

206761-90-2 | Hydrazinecarbothioamide, N-[4-(trifluoromethyl)phenyl]-

CAS No: 206761-90-2 Catalog No: AG002IOD MDL No:MFCD00041301

Product Description

Catalog Number:
AG002IOD
Chemical Name:
Hydrazinecarbothioamide, N-[4-(trifluoromethyl)phenyl]-
CAS Number:
206761-90-2
Molecular Formula:
C8H8F3N3S
Molecular Weight:
235.2294
MDL Number:
MFCD00041301
IUPAC Name:
1-amino-3-[4-(trifluoromethyl)phenyl]thiourea
InChI:
InChI=1S/C8H8F3N3S/c9-8(10,11)5-1-3-6(4-2-5)13-7(15)14-12/h1-4H,12H2,(H2,13,14,15)
InChI Key:
NWPGZYRPTJGBPI-UHFFFAOYSA-N
SMILES:
NNC(=S)Nc1ccc(cc1)C(F)(F)F

Properties

Complexity:
224  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
235.039g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
235.228g/mol
Monoisotopic Mass:
235.039g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
82.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7  

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