6-(Trifluoromethyl)-1H-indole-2-carboxylic acid
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6-(Trifluoromethyl)-1H-indole-2-carboxylic acid
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CAS No:
327-20-8
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Formula:
C10H6F3NO2
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Chemical Name:
6-(Trifluoromethyl)-1H-indole-2-carboxylic acid
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Synonyms:
1H-Indole-2-carboxylic acid,6-(trifluoromethyl)-;Indole-2-carboxylic acid,6-(trifluoromethyl)-;6-(Trifluoromethyl)-1H-indole-2-carboxylic acid
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CAS No:
6-(Trifluoromethyl)-1H-indole-2-carboxylic acid Basic Attributes
229.155
229.16
DTXSID50404175
2933990090
Characteristics
53.09000
2.88
1.5±0.1 g/cm3
163-164 °C
402.5±40.0 °C at 760 mmHg
197.2±27.3 °C
1.598
Safety Information
|Warning|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501|The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Computed Properties
Molecular Weight:229.15
XLogP3:3.2
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:1
Exact Mass:229.03506292
Monoisotopic Mass:229.03506292
Topological Polar Surface Area:53.1
Heavy Atom Count:16
Complexity:292
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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6-(Trifluoromethyl)-1H-indole-2-carboxylic acid
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