4-(Trifluoromethyl)benzylamine
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4-(Trifluoromethyl)benzylamine
structure -
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CAS No:
3300-51-4
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Formula:
C8H8F3N
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Chemical Name:
4-(Trifluoromethyl)benzylamine
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Synonyms:
Benzenemethanamine,4-(trifluoromethyl)-;Benzylamine,p-(trifluoromethyl)-;4-(Trifluoromethyl)benzenemethanamine;p-(Trifluoromethyl)benzylamine;4-(Trifluoromethyl)benzylamine;((4-(Trifluoromethyl)phenyl)methyl)amine;1-[4-(Trifluoromethyl)phenyl]methanamine;(4-Trifluoromethylphenyl)methanamine;1-(4-Trifluoromethylphenyl)methylamine
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CAS No:
Characteristics
26
1.8
clear colorless to light yellow liquid
1.2±0.1 g/cm3
43 °C
114-120 °C
75.0±0.0 °C
1.467
Safety Information
III
8
2735
3
R36/37/38
S26-S36-S45-S36/37/39
Xi:Irritant;
P261-P305 + P351 + P338
H315-H319-H335
|Danger|H314 (19.15%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]|P260, P261, P264, P271, P280, P301+P330+P331, P302+P352, P303+P361+P353, P304+P340, P305+P351+P338, P310, P312, P321, P332+P313, P337+P313, P362, P363, P403+P233, P405, and P501|Aggregated GHS information provided by 47 companies from 5 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.|Warning|H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]|P264, P280, P302+P352, P305+P351+P338, P321, P332+P313, P337+P313, and P362|The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
4-(Trifluoromethyl)benzylamine Use and Manufacturing
5.00 g (26.4 mmol) of this 4-trifluoromethylbenzaldehyde oxime were dissolved in methanol followed by the addition of 4.0 g (109.7 mmol) of hydrogen chloride gas and 252 mg of the same catalyst as that of and stirring for 3 hours in a hydrogen atmosphere at 10 atm and room temperature (approx. 250° C.).
Computed Properties
Molecular Weight:175.15
XLogP3:1.8
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:1
Exact Mass:175.06088375
Monoisotopic Mass:175.06088375
Topological Polar Surface Area:26
Heavy Atom Count:12
Complexity:136
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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