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Home > Fluorides > 156970-38-6
156970-38-6 | 3-Fluoro-2-methylphenylthiourea
CAS No: 156970-38-6 Catalog No: AG01FEXL MDL No:MFCD15525437
Product Description
Catalog Number:
AG01FEXL
Chemical Name:
3-Fluoro-2-methylphenylthiourea
CAS Number:
156970-38-6
Molecular Formula:
C8H9FN2S
Molecular Weight:
184.2339
MDL Number:
MFCD15525437
IUPAC Name:
(3-fluoro-2-methylphenyl)thiourea
InChI:
InChI=1S/C8H9FN2S/c1-5-6(9)3-2-4-7(5)11-8(10)12/h2-4H,1H3,(H3,10,11,12)
InChI Key:
ZHLWJSYVZICLLM-UHFFFAOYSA-N
SMILES:
Cc1c(NC(=S)N)cccc1F
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
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