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CAS Number: 875305-87-6
5-fluoro-1H-indole-7-carboxylic acid

Structure

5-fluoro-1H-indole-7-carboxylic acid
Name: 5-fluoro-1H-indole-7-carboxylic acid
Synonyms:
General Information
Product Number: 875305876

CAS Registry Number 875305-87-6
Name:
1H-?Indole-?7-?carboxylic acid, 5-?fluoro-
5-Fluoro-1H-indole-7-carboxylic acid

 

Chemical Formula: C9H6FNO2
Exact Mass: 179.04
Molecular Weight: 179.15
m/z: 179.04 (100.0%), 180.04 (10.2%)

 

InChI:InChI=1S/C9H6FNO2/c10-6-3-5-1-2-11-8(5)7(4-6)9(12)13/h1-4,11H,(H,12,13)

InChI Key:SXLQIJMLVHUFKL-UHFFFAOYSA-N

Canonical SMILES:C1=CNC2=C(C=C(C=C21)F)C(=O)O

 

Thermal Properties Value Condition Note
Melting Point 210-212 °C Solv: ethanol (64-17-5) (2)CAS

Specification

98%

References

(2) Schlosser, Manfred; European Journal of Organic Chemistry 2006, (13), P2956-2969 CAPLUS

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