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CAS Number: 71293-62-4
5-(trifluoromethyl)indolin-2-one

Structure

5-(trifluoromethyl)indolin-2-one
Name: 5-(trifluoromethyl)indolin-2-one
Synonyms:
General Information
Product Number: 71293624

CAS Registry Number 71293-62-4
Name:
2H-?Indol-?2-?one, 1,?3-?dihydro-?5-?(trifluoromethyl)?-
1,3-Dihydro-5-(trifluoromethyl)-2H-indol-2-one
5-(Trifluoromethyl)-1,3-dihydroindol-2-one
5-(Trifluoromethyl)-2-oxindole
5-(Trifluoromethyl)indolin-2-one
5-(Trifluoromethyl)oxindole

 

Chemical Formula: C9H6F3NO
Exact Mass: 201.04
Molecular Weight: 201.15
m/z: 201.04 (100.0%), 202.04 (10.1%)

 

InChI:InChI=1S/C9H6F3NO/c10-9(11,12)6-1-2-7-5(3-6)4-8(14)13-7/h1-3H,4H2,(H,13,14)

InChI Key:RANTVMNWZIWPNR-UHFFFAOYSA-N

Canonical SMILES:C1C2=C(C=CC(=C2)C(F)(F)F)NC1=O

 

Thermal Properties Value Condition Note
Melting Point 191-200 °C Solv: ethanol (64-17-5) (2)CAS
Melting Point 189.5-190.5 °C   (3)IC
Melting Point 189.5-190.5 °C   (4)IC
Melting Point 189.5-190.5 °C   (5)IC
Melting Point 189.5-190.5 °C   (6)IC
Melting Point 188-200 °C   (1)CAS

Specification

98%

References
  1. (1) Xie, Jinwen; Journal of Combinatorial Chemistry 2007, V9(4), P566-568 CAPLUS
  2. (2) Dandia, A.; Ultrasonics Sonochemistry 2011, V18(5), P1143-1147 CAPLUS
  3. (3) Kadin, Saul Bernard; EP 153818 A2 1985 CAPLUS
  4. (4) Kadin, Saul B.; US 4690943 A 1987 CAPLUS
  5. (5) Kadin, Saul B.; US 4721712 A 1988 CAPLUS
  6. (6) Kadin, Saul B.; US 4730004 A 1988 CAPLUS
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