Structure

7-Methylguanine

CAS
578-76-7
Catalog Number
ACM578767
Category
Other Products
Molecular Weight
165.15
Molecular Formula
C6H7N5O

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Specification

Synonyms
2-Amino-7-methylhypoxanthine
IUPAC Name
2-Amino-7-methyl-1H-purin-6-one
Canonical SMILES
CN1C=NC2=C1C(=O)NC(=N2)N
InChI
InChI=1S/C6H7N5O/c1-11-2-8-4-3(11)5(12)10-6(7)9-4/h2H,1H3,(H3,7,9,10,12)
InChI Key
FZWGECJQACGGTI-UHFFFAOYSA-N
Boiling Point
292.98 °C
Melting Point
370 °C
Flash Point
258.6 °C
Density
1.3629 g/cm³
Appearance
Solid
Storage
Keep in dark place, inert atmosphere, room temperature
Complexity
250
Exact Mass
165.06505986
Monoisotopic Mass
165.06505986
pKa
9.78±0.20(Predicted)
Refractive Index
1.8500
Topological Polar Surface Area
85.3 Ų
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