2-(Trifluoromethyl)benzamide
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2-(Trifluoromethyl)benzamide
structure -
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CAS No:
360-64-5
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Formula:
C8H6F3NO
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Chemical Name:
2-(Trifluoromethyl)benzamide
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Synonyms:
Benzamide,2-(trifluoromethyl)-;o-Toluamide,α,α,α-trifluoro-;2-(Trifluoromethyl)benzamide
- Categories:
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CAS No:
2-(Trifluoromethyl)benzamide Basic Attributes
189.14
189.13
206-637-2
5U8Y7E6AIO
DTXSID40189560
2924299090
Safety Information
NONH for all modes of transport
3
R36/37/38
S26-S36
Xi: Irritant;
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, P501
H302
2-(Trifluoromethyl)benzamide Use and Manufacturing
2-Trifluoromethyl benzoyl chloride (50 g) and iso-propanol (400 g) were taken in a reaction vessel and ammonia gas was purged into it. The reaction was allowed to stir for 3.5 hours at a temperature in the range of -10°C to 0°C to facilitate the reaction. The ammonium chloride was precipitated out and the reaction mixture was filtered to obtain a filtrate. The filtrate was concentrated to obtain the compound of Formula I. Yield: 90percent Purity (percent by HPLC): 99percentStep 1:
Benzamide, 2-(trifluoromethyl)-: ACTIVE|PMN - indicates a commenced PMN (Pre-Manufacture Notices) substance.
Environmental transformation -> Pesticide transformation products (metabolite, successor)
Benzamide is a known environmental transformation product of Fluopyram.
Computed Properties
Molecular Weight:189.13
XLogP3:0.7
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:1
Exact Mass:189.04014830
Monoisotopic Mass:189.04014830
Topological Polar Surface Area:43.1
Heavy Atom Count:13
Complexity:202
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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