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112889-53-9 | 2-Chloro-5-fluoro-4-thiocyanopyrimidine
CAS No: 112889-53-9 Catalog No: AG01FH0Z MDL No:
Product Description
Catalog Number:
AG01FH0Z
Chemical Name:
2-Chloro-5-fluoro-4-thiocyanopyrimidine
CAS Number:
112889-53-9
IUPAC Name:
(2-chloro-5-fluoropyrimidin-4-yl) thiocyanate
InChI:
InChI=1S/C5HClFN3S/c6-5-9-1-3(7)4(10-5)11-2-8/h1H
InChI Key:
JOERDQDFDHRQBC-UHFFFAOYSA-N
Properties
Complexity:
182
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
188.956g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
189.592g/mol
Monoisotopic Mass:
188.956g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
74.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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