3-Pyridinecarbothioamide, 6-chloro-


Chemical Name: 3-Pyridinecarbothioamide, 6-chloro-
CAS Number: 400776-16-1
Product Number: AG00I7UV(AGN-PC-0218NH)
Synonyms:
MDL No:
Molecular Formula: C6H5ClN2S
Molecular Weight: 172.6353

Identification/Properties


Computed Properties
Molecular Weight:
172.63g/mol
XLogP3:
2.6
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
1
Exact Mass:
171.986g/mol
Monoisotopic Mass:
171.986g/mol
Topological Polar Surface Area:
71A^2
Heavy Atom Count:
10
Formal Charge:
0
Complexity:
140
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
N/A
Signal Word:
UN#:
-
Hazard Statements:
-
Precautionary Statements:
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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