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Home > Other Building Blocks > 1006-08-2
1006-08-2 | 6H-Purin-6-one, 1,7-dihydro-7-methyl-
CAS No: 1006-08-2 Catalog No: AG0002FJ MDL No:MFCD26131841
Product Description
Catalog Number:
AG0002FJ
Chemical Name:
6H-Purin-6-one, 1,7-dihydro-7-methyl-
CAS Number:
1006-08-2
Molecular Formula:
C6H6N4O
Molecular Weight:
150.1380
MDL Number:
MFCD26131841
IUPAC Name:
7-methyl-1H-purin-6-one
InChI:
InChI=1S/C6H6N4O/c1-10-3-9-5-4(10)6(11)8-2-7-5/h2-3H,1H3,(H,7,8,11)
InChI Key:
CBQMKYHLDADRLN-UHFFFAOYSA-N
SMILES:
Cn1cnc2c1c(=O)[nH]cn2
NSC Number:
7859
Properties
Complexity:
215
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
150.054g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
150.141g/mol
Monoisotopic Mass:
150.054g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
59.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.5
Literature
| Title | Journal |
|---|---|
| Calf spleen purine nucleoside phosphorylase: complex kinetic mechanism, hydrolysis of 7-methylguanosine, and oligomeric state in solution. | Biochimica et biophysica acta 20020429 |
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