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1263377-85-0 | 4-(4-Fluoro-3-methylphenyl)thiosemicarbazide
CAS No: 1263377-85-0 Catalog No: AG01FALV MDL No:MFCD00175508
Product Description
Catalog Number:
AG01FALV
Chemical Name:
4-(4-Fluoro-3-methylphenyl)thiosemicarbazide
CAS Number:
1263377-85-0
Molecular Formula:
C8H10FN3S
Molecular Weight:
199.2485
MDL Number:
MFCD00175508
IUPAC Name:
1-amino-3-(4-fluoro-3-methylphenyl)thiourea
InChI:
InChI=1S/C8H10FN3S/c1-5-4-6(2-3-7(5)9)11-8(13)12-10/h2-4H,10H2,1H3,(H2,11,12,13)
InChI Key:
YUVWWJSGGXQAOT-UHFFFAOYSA-N
SMILES:
NNC(=S)Nc1ccc(c(c1)C)F
Properties
Complexity:
188
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
199.058g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
199.247g/mol
Monoisotopic Mass:
199.058g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
82.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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