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9H-Purine-9-carbaldehyde
[CAS# 634890-94-1]

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Identification
Name 9H-Purine-9-carbaldehyde
Synonyms 9H-purine-9-carbaldehyde; 9H-PURINE-9-CARBOXALDEHYDE (9CI)
Molecular Structure CAS#: 634890-94-1, 9H-Purine-9-carbaldehyde
Molecular Formula C6H4N4O
Molecular Weight 148.12
CAS Registry Number 634890-94-1
SMILES c1c2c(ncn1)n(cn2)C=O
InChI 1S/C6H4N4O/c11-4-10-3-9-5-1-7-2-8-6(5)10/h1-4H
InChIKey NWTTWBRNVZBILQ-UHFFFAOYSA-N
Properties
Density 1.572g/cm3 (Cal.)
Boiling point 355.949°C at 760 mmHg (Cal.)
Flash point 169.072°C (Cal.)
Refractive index 1.768 (Cal.)
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