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CAS Number: 6214-65-9
5-acetylpyrimidine-2,4(1H,3H)-dione

Structure

5-acetylpyrimidine-2,4(1H,3H)-dione
Name: 5-acetylpyrimidine-2,4(1H,3H)-dione
Synonyms:
General Information
Product Number: 6214659

CAS Registry Number 6214-65-9
Name:
2,?4(1H,?3H)?-?Pyrimidinedione, 5-?acetyl-
Uracil, 5-acetyl- (6CI,7CI,8CI)
5-Acetouracil
5-Acetyluracil
NSC 34716

 

Chemical Formula: C6H6N2O3
Exact Mass: 154.04
Molecular Weight: 154.12
m/z: 154.04 (100.0%), 155.04 (6.7%)

 

InChI:InChI=1S/C6H6N2O3/c1-3(9)4-2-7-6(11)8-5(4)10/h2H,1H3,(H2,7,8,10,11)

InChI Key:YNYDWEIQSDFDLK-UHFFFAOYSA-N

Canonical SMILES:CC(=O)C1=CNC(=O)NC1=O

 

Thermal Properties Value Condition Note
Melting Point 294 °C (decomp)   (5)CAS
Melting Point 294 °C (decomp)   (6)IC
Melting Point 293-295 °C Solv: water (7732-18-5) (1)CAS
Melting Point 283-285 °C (decomp)   (7)CAS
Melting Point See full text   (8)CAS

Specification

98%

References
  1. (1) Scherbinina, E. S.; Chemistry of Heterocyclic Compounds (New York, NY, United States) 2010, V46(9), P1109-1115 CAPLUS
  2. (5) Bergmann, Werner; Berichte der Deutschen Chemischen Gesellschaft [Abteilung] B: Abhandlungen 1933, V66B, P1492-6 CAPLUS
  3. (6) Kundu, Nitya G.; Journal of Heterocyclic Chemistry 1982, V19(3), P463-4 CAPLUS
  4. (7) Dewar, J. H.; Journal of the Chemical Society 1961, P3254-60 CAPLUS
  5. (8) Whitehead, Calvert W.; US 2774760 1956 CAPLUS
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