2,6,7,8-tetrahydrocyclopenta[2,3]thieno[2,4-d]pyrimidin-1-one


Chemical Name: 2,6,7,8-tetrahydrocyclopenta[2,3]thieno[2,4-d]pyrimidin-1-one
CAS Number: 14346-25-9
Product Number: AG007K2W(AGN-PC-0JMZB4)
Synonyms:
MDL No:
Molecular Formula: C9H8N2OS
Molecular Weight: 192.2376

Identification/Properties


Computed Properties
Molecular Weight:
192.236g/mol
XLogP3:
1.4
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
0
Exact Mass:
192.036g/mol
Monoisotopic Mass:
192.036g/mol
Topological Polar Surface Area:
69.7A^2
Heavy Atom Count:
13
Formal Charge:
0
Complexity:
279
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:
H315-H319-H335
Precautionary Statements:
P261-P280-P304+P340-P305+P351+P338-P405-P501
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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