4(1H)-Pteridinone


Chemical Name: 4(1H)-Pteridinone
CAS Number: 700-47-0
Product Number: AG0038H3(AGN-PC-0LQBED)
Synonyms:
MDL No:
Molecular Formula: C6H4N4O
Molecular Weight: 148.1222

Identification/Properties


Computed Properties
Molecular Weight:
148.125g/mol
XLogP3:
-0.8
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
0
Exact Mass:
148.039g/mol
Monoisotopic Mass:
148.039g/mol
Topological Polar Surface Area:
67.2A^2
Heavy Atom Count:
11
Formal Charge:
0
Complexity:
203
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#:
N/A
Hazard Statements:
H302-H315-H319
Precautionary Statements:
P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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