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Home > Fluorides > 572889-25-9
572889-25-9 | (2,3-Difluorophenyl)thiourea
CAS No: 572889-25-9 Catalog No: AG003BKK MDL No:MFCD07368705
Product Description
Catalog Number:
AG003BKK
Chemical Name:
(2,3-Difluorophenyl)thiourea
CAS Number:
572889-25-9
Molecular Formula:
C7H6F2N2S
Molecular Weight:
188.1977
MDL Number:
MFCD07368705
IUPAC Name:
(2,3-difluorophenyl)thiourea
InChI:
InChI=1S/C7H6F2N2S/c8-4-2-1-3-5(6(4)9)11-7(10)12/h1-3H,(H3,10,11,12)
InChI Key:
UUQZTECZSCPOLX-UHFFFAOYSA-N
SMILES:
NC(=S)Nc1cccc(c1F)F
Properties
Complexity:
177
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
188.022g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
188.196g/mol
Monoisotopic Mass:
188.022g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
70.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
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