CAS:90417-31-5 / ethyl 5-cyanonicotinate--Hangzhou Chempro Technology Co., Ltd.

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CAS Number: 90417-31-5
ethyl 5-cyanonicotinate

Structure
Name: ethyl 5-cyanonicotinate
Synonyms:

General Information

Product Number: 90417315

CAS Registry Number 90417-31-5
Name:
3-Pyridinecarboxylic acid, 5-cyano-, ethyl ester
Nicotinic acid, 5-cyano-, ethyl ester (6CI,7CI)
Ethyl 5-cyano-3-pyridinecarboxylate
Ethyl 5-cyanonicotinate
NSC 620233

Chemical Formula: C9H8N2O2
Exact Mass: 176.06
Molecular Weight: 176.17
m/z: 176.06 (100.0%), 177.06 (10.6%)

InChI:InChI=1S/C9H8N2O2/c1-2-13-9(12)8-3-7(4-10)5-11-6-8/h3,5-6H,2H2,1H3

InChI Key:PQINZTXTQYRDBV-UHFFFAOYSA-N

Canonical SMILES:CCOC(=O)C1=CN=CC(=C1)C#N

Thermal Properties	Value	Condition	Note
Boiling Point	143-145 °C	Press: 16 Torr	(1)CAS
Melting Point	89-90 °C	Solv: ligroine (8032-32-4)	(1)CAS
Melting Point	88 °C	Solv: water (7732-18-5); methanol (67-56-1)	(2)CAS

Specification

98%

References

(1) Kuthan, J.; Collection of Czechoslovak Chemical Communications 1964, V29, P143-51 CAPLUS
(2) Bohlmann, Ferdinand; Justus Liebigs Annalen der Chemie 1954, V587, P162-76 CAPLUS

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