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CAS Number: 39073-14-8
ethyl 2-chloro-6-methylnicotinate

Structure

ethyl 2-chloro-6-methylnicotinate
Name: ethyl 2-chloro-6-methylnicotinate
Synonyms:
General Information
Product Number: 39073148
CAS Registry Number: 39073-14-8
Name:
3-​Pyridinecarboxylic acid, 2-​chloro-​6-​methyl-​, ethyl ester
Nicotinic acid, 2-​chloro-​6-​methyl-​, ethyl ester (7CI); 2-​Chloro-​6-​methylnicotinic acid ethyl ester; Ethyl 2-​chloro-​6-​methylpyridine-​3-​carboxylate 
 
Chemical Formula: C9H10ClNO2
Exact Mass: 199.04
Molecular Weight: 199.63
m/z: 199.04 (100.0%), 201.04 (32.4%), 200.04 (10.2%), 202.04 (3.2%)
Elemental Analysis: C, 54.15; H, 5.05; Cl, 17.76; N, 7.02; O, 16.03
 
InChI: InChI=1S/C9H10ClNO2/c1-3-13-9(12)7-5-4-6(2)11-8(7)10/h4-5H,3H2,1-2H3
InChIKey: MRPGVPAVDMEQED-UHFFFAOYSA-N
Canonical SMILES : CCOC(=O)C1=C(N=C(C=C1)C)Cl
 
Thermal Properties Value Condition Note
Boiling Point 130 °C Press: 8 Torr (1)IC
Melting Point 27-29 °C   (1)IC

Specification

98%

References
  1. (1) Zawisza, Tadeusz; Acta Poloniae Pharmaceutica 1981, V38(2), P145-52 CAPLUS
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