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CAS Number: 100487-74-9
6-chloro-5-fluoroindolin-2-one

Structure

6-chloro-5-fluoroindolin-2-one
Name: 6-chloro-5-fluoroindolin-2-one
Synonyms:
General Information
Product Number: 100487749

CAS Registry Number 100487-74-9
Name:
2H-​Indol-​2-​one, 6-​chloro-​5-​fluoro-​1,​3-​dihydro-
6-Chloro-5-fluoro-1,3-dihydroindol-2-one
6-Chloro-5-fluoro-2-oxindole
6-Chloro-5-fluoroindolin-2-one

 

Chemical Formula: C8H5ClFNO
Exact Mass: 185.00
Molecular Weight: 185.58
m/z: 185.00 (100.0%), 187.00 (32.0%), 186.01 (8.7%), 188.00 (2.9%)

 

InChI:InChI=1S/C8H5ClFNO/c9-5-3-7-4(1-6(5)10)2-8(12)11-7/h1,3H,2H2,(H,11,12)

InChI Key:QDUXBJGXHPPFJG-UHFFFAOYSA-N

Canonical SMILES:C1C2=CC(=C(C=C2NC1=O)Cl)F

 

Thermal Properties Value Condition Note
Melting Point 196-206 °C   (1)IC
Melting Point 196-206 °C   (2)IC
Melting Point 196-206 °C   (3)IC
Melting Point 196-206 °C Solv: toluene (108-88-3) (3)IC
Melting Point 196-206 °C Solv: toluene (108-88-3) (4)IC

Specification

98%

References
  1. (1) Kadin, Saul Bernard; EP 153818 A2 1985 CAPLUS
  2. (2) Kadin, Saul B.; US 4721712 A 1988 CAPLUS
  3. (3) Kadin, Saul B.; US 4690943 A 1987 CAPLUS
  4. (4) Kadin, Saul B.; US 4730004 A 1988 CAPLUS
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