6H-Purine-6-thione, 1,7-dihydro-


Chemical Name: 6H-Purine-6-thione, 1,7-dihydro-
CAS Number: 50-44-2
Product Number: AG0038PH(AGN-PC-0OBCLT)
Synonyms:
MDL No:
Molecular Formula: C5H4N4S
Molecular Weight: 152.1771

Identification/Properties


Computed Properties
Molecular Weight:
152.175g/mol
XLogP3:
0
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
0
Exact Mass:
152.016g/mol
Monoisotopic Mass:
152.016g/mol
Topological Polar Surface Area:
85.2A^2
Heavy Atom Count:
10
Formal Charge:
0
Complexity:
190
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:
Signal Word:
Warning
UN#:
-
Hazard Statements:
H302-H315-H319-H335
Precautionary Statements:
P261-P280-P301+P312-P302+P352-P305+P351+P338
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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