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CAS Number: 53135-24-3
ethyl 2-methyl-6-oxo-1,6-dihydropyrimidine-5-carboxylate

Structure

ethyl 2-methyl-6-oxo-1,6-dihydropyrimidine-5-carboxylate
Name: ethyl 2-methyl-6-oxo-1,6-dihydropyrimidine-5-carboxylate
Synonyms:
General Information
Product Number: 53135243
CAS Registry Number: 53135-24-3
Name:
5-​Pyrimidinecarboxylic acid, 3,​4-​dihydro-​2-​methyl-​4-​oxo-​, ethyl ester
5-​Pyrimidinecarboxylic acid, 1,​4-​dihydro-​2-​methyl-​4-​oxo-​, ethyl ester (9CI); Ethyl 2-​methyl-​6-​oxo-​1,​6-​dihydro-​5-​pyrimidinecarboxylat​e; Ethyl 3,​4-​dihydro-​2-​methyl-​4-​oxopyrimidine-​5-​carboxylate; Ethyl 4-​hydroxy-​2-​methyl-​5-​pyrimidine carboxylate; NSC 160874 
 
Chemical Formula: C8H10N2O3
Exact Mass: 182.07
Molecular Weight: 182.18
m/z: 182.07 (100.0%), 183.07 (9.5%)
Elemental Analysis: C, 52.74; H, 5.53; N, 15.38; O, 26.35
 
InChI: InChI=1S/C8H10N2O3/c1-3-13-8(12)6-4-9-5(2)10-7(6)11/h4H,3H2,1-2H3,(H,9,10,11)
InChIKey: KTZQDIINDVWLES-UHFFFAOYSA-N
Canonical SMILES : CCOC(=O)C1=CN=C(NC1=O)C
 
Thermal Properties Value Condition Note
Melting Point 191-192 °C   (2)CAS
Melting Point 191 °C   (3)CAS
Melting Point 191 °C Solv: acetone (67-64-1) (4)CAS
Melting Point 190.5-191.5 °C Solv: acetone (67-64-1) (5)CAS
Melting Point 190-192 °C Solv: acetone (67-64-1) (1)IC

Specification

98%

References
  1. (1) Baxter, Robert L.; Journal of the Chemical Society, Perkin Transactions 1: Organic and Bio-Organic Chemistry (1972-1999) 1990, (11), P2963-6 CAPLUS
  2. (2) Fukumoto, Masashi; JP 2003321472 A 2003 CAPLUS
  3. (3) Todd, A. R.; Journal of the Chemical Society 1937, P364-7 CAPLUS
  4. (4) Yano, Kiyoshi; JP 25000848 B4 1950 CAPLUS
  5. (5) Geissman, T. A.; Journal of Organic Chemistry 1946, V11, P741-50 CAPLUS
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