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Home > Fluorides > 142229-74-1
142229-74-1 | Thiourea, N-[4-(trifluoromethoxy)phenyl]-
CAS No: 142229-74-1 Catalog No: AG001I14 MDL No:MFCD00052992
Product Description
Catalog Number:
AG001I14
Chemical Name:
Thiourea, N-[4-(trifluoromethoxy)phenyl]-
CAS Number:
142229-74-1
Molecular Formula:
C8H7F3N2OS
Molecular Weight:
236.2142
MDL Number:
MFCD00052992
IUPAC Name:
[4-(trifluoromethoxy)phenyl]thiourea
InChI:
InChI=1S/C8H7F3N2OS/c9-8(10,11)14-6-3-1-5(2-4-6)13-7(12)15/h1-4H,(H3,12,13,15)
InChI Key:
UCOXNOVULREFCO-UHFFFAOYSA-N
SMILES:
NC(=S)Nc1ccc(cc1)OC(F)(F)F
Properties
Complexity:
226
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
236.023g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
236.212g/mol
Monoisotopic Mass:
236.023g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
79.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
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