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CAS Number: 101349-12-6
2-(5-fluoro-1H-indol-3-yl)ethanol

Structure

2-(5-fluoro-1H-indol-3-yl)ethanol
Name: 2-(5-fluoro-1H-indol-3-yl)ethanol
Synonyms:
General Information
Product Number: 101349126

CAS Registry Number 101349-12-6
Name:
1H-​Indole-​3-​ethanol, 5-​fluoro-
2-(5-Fluoro-1H-indol-3-yl)ethanol
5-Fluoro-1H-indole-3-ethanol
5-Fluoro-3-(2-hydroxyethyl)indole
5-Fluorotryptophol

 

Chemical Formula: C10H10FNO
Exact Mass: 179.07
Molecular Weight: 179.19
m/z: 179.07 (100.0%), 180.08 (11.0%)

 

InChI:InChI=1S/C10H10FNO/c11-8-1-2-10-9(5-8)7(3-4-13)6-12-10/h1-2,5-6,12-13H,3-4H2

InChI Key:MXTYSYXDDDVPBQ-UHFFFAOYSA-N

Canonical SMILES:C1=CC2=C(C=C1F)C(=CN2)CCO

 

Thermal Properties Value Condition Note
Melting Point 89-91 °C   (2)IC
Melting Point 89-91 °C Solv: benzene (71-43-2) (3)IC
Melting Point 59-61 °C   (4)CAS

Specification

98%

References
  1. (2) Rajanbabu, Thaliyil V.; US 4659862 A 1987 CAPLUS
  2. (3) RajanBabu, T. V.; Journal of Organic Chemistry 1986, V51(10), P1704-12 CAPLUS
  3. (4) Mewshaw, Richard E.; Journal of Medicinal Chemistry 2004, V47(15), P3823-3842 CAPLUS
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