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1263377-46-3 | 2-Chloro-3-fluorophenylthiourea
CAS No: 1263377-46-3 Catalog No: AG01FEV0 MDL No:MFCD18379897
Product Description
Catalog Number:
AG01FEV0
Chemical Name:
2-Chloro-3-fluorophenylthiourea
CAS Number:
1263377-46-3
Molecular Formula:
C7H6ClFN2S
Molecular Weight:
204.6523
MDL Number:
MFCD18379897
IUPAC Name:
(2-chloro-3-fluorophenyl)thiourea
InChI:
InChI=1S/C7H6ClFN2S/c8-6-4(9)2-1-3-5(6)11-7(10)12/h1-3H,(H3,10,11,12)
InChI Key:
UULBOZBQSOIZKU-UHFFFAOYSA-N
SMILES:
NC(=S)Nc1cccc(c1Cl)F
Properties
Complexity:
179
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
203.992g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
204.647g/mol
Monoisotopic Mass:
203.992g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
70.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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