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CAS Number: 39931-77-6
ethyl 2-(pyridin-3-yl)acetate

Structure

ethyl 2-(pyridin-3-yl)acetate
Name: ethyl 2-(pyridin-3-yl)acetate
Synonyms:
General Information
Product Number: 39931776
CAS Registry Number: 39931-77-6
Name:
        3-​Pyridineacetic acid, ethyl ester
        (3-​Pyridyl)​acetic acid ethyl ester; 2-​(Pyridin-​3-​yl)​acetic acid ethyl ester; Ethyl 2-​(pyridin-​3-​yl)​acetate; Ethyl 3-​pyridineacetate; Ethyl 3-​pyridinylacetate; Ethyl 3-​pyridylacetate; NSC 76091; Pyridin-​3-​ylacetic acid ethyl ester 
 
Chemical Formula: C9H11NO2
Exact Mass: 165.08
Molecular Weight: 165.19
m/z: 165.08 (100.0%), 166.08 (10.2%)
Elemental Analysis: C, 65.44; H, 6.71; N, 8.48; O, 19.37
 
InChI: InChI=1S/C9H11NO2/c1-2-12-9(11)6-8-4-3-5-10-7-8/h3-5,7H,2,6H2,1H3
InChIKey: RPWXYCRIAGBAGY-UHFFFAOYSA-N
Canonical SMILES : CCOC(=O)CC1=CN=CC=C1
 
Thermal Properties Value Condition Note
Boiling Point 124 °C Press: 12 Torr (2)CAS
Boiling Point 122 °C Press: 13 Torr (3)CAS
Boiling Point 122 °C Press: 13 Torr (4)CAS
Boiling Point 122 °C Press: 13 Torr (5)CAS
Boiling Point 121 °C Press: 10 Torr (6)CAS

Specification

98%

References

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  • (9) Shang, Rui; Angewandte Chemie, International Edition 2011, V50(19), P4470-4474, S4470/1-S4470/189 CAPLU
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