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CAS Number: 2226-86-0
ethyl 2,4-dimethylpyrimidine-5-carboxylate

Structure

ethyl 2,4-dimethylpyrimidine-5-carboxylate
Name: ethyl 2,4-dimethylpyrimidine-5-carboxylate
Synonyms:
General Information
Product Number: 2226860
CAS Registry Number: 2226-86-0
Name:
5-​Pyrimidinecarboxylic acid, 2,​4-​dimethyl-​, ethyl ester
Ethyl 2,​4-​dimethyl-​5-​pyrimidinecarboxylat​e; NSC 165510 
 
Chemical Formula: C9H12N2O2
Exact Mass: 180.09
Molecular Weight: 180.20
m/z: 180.09 (100.0%), 181.09 (10.5%)
Elemental Analysis: C, 59.99; H, 6.71; N, 15.55; O, 17.76
 
InChI: InChI=1S/C9H12N2O2/c1-4-13-9(12)8-5-10-7(3)11-6(8)2/h5H,4H2,1-3H3
InChIKey: WCMYQNCFRCBDFG-UHFFFAOYSA-N
Canonical SMILES : CCOC(=O)C1=CN=C(N=C1C)C
 
Thermal Properties Value Condition Note
Boiling Point 113-115 °C Press: 12 Torr (1)CAS
Boiling Point 80-81 °C Press: 0.6 Torr (2)IC

Specification

98%

References
  1. (1) Urban, R.; Helvetica Chimica Acta 1958, V41, P1806-16 CAPLUS
  2. (2) Schenone, Pietro; Journal of Heterocyclic Chemistry 1990, V27(2), P295-305 CAPLUS
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