7H-Purine-7-acetic acid, 1,2,3,6-tetrahydro-1,3-dimethyl-2,6-dioxo-


Chemical Name: 7H-Purine-7-acetic acid, 1,2,3,6-tetrahydro-1,3-dimethyl-2,6-dioxo-
CAS Number: 652-37-9
Product Number: AG00E8M5(AGN-PC-0JL93N)
Synonyms:
MDL No:
Molecular Formula: C9H10N4O4
Molecular Weight: 238.2001

Identification/Properties


Properties
MP:
270-272 °C
BP:
555.7°C at 760 mmHg
Storage:
Inert atmosphere;Room Temperature;
Form:
Solid
Computed Properties
Molecular Weight:
238.203g/mol
XLogP3:
-0.8
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
2
Exact Mass:
238.07g/mol
Monoisotopic Mass:
238.07g/mol
Topological Polar Surface Area:
95.7A^2
Heavy Atom Count:
17
Formal Charge:
0
Complexity:
385
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


NMR Spectrum


Other Analytical Data


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