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1263376-23-3 | 4-(4-Bromo-3,5-difluorophenyl)thiosemicarbazide
CAS No: 1263376-23-3 Catalog No: AG01F9SI MDL No:MFCD18379868
Product Description
Catalog Number:
AG01F9SI
Chemical Name:
4-(4-Bromo-3,5-difluorophenyl)thiosemicarbazide
CAS Number:
1263376-23-3
Molecular Formula:
C7H6BrF2N3S
Molecular Weight:
282.1084
MDL Number:
MFCD18379868
IUPAC Name:
1-amino-3-(4-bromo-3,5-difluorophenyl)thiourea
InChI:
InChI=1S/C7H6BrF2N3S/c8-6-4(9)1-3(2-5(6)10)12-7(14)13-11/h1-2H,11H2,(H2,12,13,14)
InChI Key:
VIWFPRIMZRZPTD-UHFFFAOYSA-N
SMILES:
NNC(=S)Nc1cc(F)c(c(c1)F)Br
Properties
Complexity:
207
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
280.943g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
282.107g/mol
Monoisotopic Mass:
280.943g/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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