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CAS Number: 876919-08-3
methyl 3-fluoroisonicotinate

Structure

methyl 3-fluoroisonicotinate
Name: methyl 3-fluoroisonicotinate
Synonyms:
General Information
Product Number: 876919083

CAS Registry Number: 876919-08-3

Name:

4-​Pyridinecarboxylic acid, 3-​fluoro-​, methyl ester
3-​Fluoroisonicotinic acid methyl ester; Methyl 3-​fluoroisonicotinate; Methyl 3-​fluoropyridine-​4-​carboxylate 

 

Chemical Formula: C7H6FNO2
Exact Mass: 155.04
Molecular Weight: 155.13
m/z: 155.04 (100.0%), 156.04 (8.1%)
Elemental Analysis: C, 54.20; H, 3.90; F, 12.25; N, 9.03; O, 20.63

 

InChI: InChI=1S/C7H6FNO2/c1-11-7(10)5-2-3-9-4-6(5)8/h2-4H,1H3
InChIKey: KAXQMQPQJSMLLM-UHFFFAOYSA-N
Canonical SMILES : COC(=O)C1=C(C=NC=C1)F

Specification

98%

References

(1) Tjosaas, Freddy; Molecules 2006, V11(2-3), P130-133 CAPLUS

 

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