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CAS Number: 1854-45-1
1-(4-amino-5H-pyrrolo[3,4-d]pyrimidin-6(7H)-yl)ethanone

Structure

 1-(4-amino-5H-pyrrolo[3,4-d]pyrimidin-6(7H)-yl)ethanone
Name: 1-(4-amino-5H-pyrrolo[3,4-d]pyrimidin-6(7H)-yl)ethanone
Synonyms:
General Information
Product Number: 1854451

CAS Registry Number 1854-45-1
Name:
Ethanone, 1-?(4-?amino-?5,?7-?dihydro-?6H-?pyrrolo[3,?4-?d]?pyrimidin-?6-?yl)?-
5H-Pyrrolo[3,4-d]pyrimidine, 6-acetyl-4-amino-6,7-dihydro- (7CI,8CI)
NSC 107249

 

Chemical Formula: C8H10N4O
Exact Mass: 178.09
Molecular Weight: 178.19
m/z: 178.09 (100.0%), 179.09 (8.8%), 179.08 (1.5%)

 

InChI:InChI=1S/C8H10N4O/c1-5(13)12-2-6-7(3-12)10-4-11-8(6)9/h4H,2-3H2,1H3,(H2,9,10,11)

InChI Key:PWRQTCBFHZYALI-UHFFFAOYSA-N

Canonical SMILES:CC(=O)N1CC2=C(C1)N=CN=C2N

 

Thermal Properties Value Condition Note
Melting Point 311-312 °C   (1)CAS

Specification

98%
References
  1. (1) Sheradsky, Tuvia; Journal of Organic Chemistry 1965, V30(1), P194-9 CAPLUS
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