Home Other Building Blocks (3-fluoro-4-methylphenyl)thiourea

(3-fluoro-4-methylphenyl)thiourea

CAS No.:
420130-45-6
Catalog Number:
AG019OQU
Molecular Formula:
C8H9FN2S
Molecular Weight:
184.2339
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Product Description
Catalog Number:
AG019OQU
Chemical Name:
(3-fluoro-4-methylphenyl)thiourea
CAS Number:
420130-45-6
Molecular Formula:
C8H9FN2S
Molecular Weight:
184.2339
MDL Number:
MFCD07352304
IUPAC Name:
(3-fluoro-4-methylphenyl)thiourea
InChI:
InChI=1S/C8H9FN2S/c1-5-2-3-6(4-7(5)9)11-8(10)12/h2-4H,1H3,(H3,10,11,12)
InChI Key:
RMSNWOXIGGJJJW-UHFFFAOYSA-N
SMILES:
NC(=S)Nc1ccc(c(c1)F)C
Properties
Complexity:
174  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
184.047g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
184.232g/mol
Monoisotopic Mass:
184.047g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
70.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6  
Properties