Purine

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Catalog Number
ACM120730
Product Name
Purine
Structure
Structure
CAS
120-73-0
Category
Heterocyclic Organic Compound
Synonyms
Imidazo(4,5-d)pyrimidine
IUPAC Name
7H-Purine
Molecular Weight
120.11
Molecular Formula
C5H4N4
Canonical SMILES
C1=C2C(=NC=N1)N=CN2
InChI
InChI=1S/C5H4N4/c1-4-5(8-2-6-1)9-3-7-4/h1-3H,(H,6,7,8,9)
InChI Key
KDCGOANMDULRCW-UHFFFAOYSA-N
Boiling Point
214.09 °C
Melting Point
214-217 °C(lit.)
Flash Point
225.4 °C
Density
1.3106 g/cm³
Appearance
White crystals
Storage
Keep in dark place, sealed in dry, room temperature
Complexity
105
Exact Mass
120.043596145
Monoisotopic Mass
120.043596145
pKa
2.3(at 20 °C)
Refractive Index
1.7380
Topological Polar Surface Area
54.5 Ų
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