4(1H)-Quinazolinone, 2,3,5,6,7,8-hexahydro-2-thioxo-


Chemical Name: 4(1H)-Quinazolinone, 2,3,5,6,7,8-hexahydro-2-thioxo-
CAS Number: 16064-21-4
Product Number: AG007VM5(AGN-PC-0KK7WQ)
Synonyms:
MDL No:
Molecular Formula: C8H10N2OS
Molecular Weight: 182.2428

Identification/Properties


Computed Properties
Molecular Weight:
182.241g/mol
XLogP3:
0.8
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
0
Exact Mass:
182.051g/mol
Monoisotopic Mass:
182.051g/mol
Topological Polar Surface Area:
73.2A^2
Heavy Atom Count:
12
Formal Charge:
0
Complexity:
283
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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