4-Chloro-3-(trifluoromethyl)phenylboronic acid
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4-Chloro-3-(trifluoromethyl)phenylboronic acid
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CAS No:
176976-42-4
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Formula:
C7H5BClF3O2
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Chemical Name:
4-Chloro-3-(trifluoromethyl)phenylboronic acid
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Synonyms:
AKOS BRN-0227;4-CHLORO-3-(TRIFLUOROMETHYL)BENZENEBORONIC ACID;4-CHLORO-3-(TRIFLUOROMETHYL)PHENYLBORONIC ACID;4-CHLORO-3-(TRIFLUOROMETYHL)PHENYLBORONIC ACID;4-Chloro-3-(Trifluoromethyl)Ph;4-Chloro-3-(trifluor;4-Chloro-3-(trifluoroMethyl)phenylboronic Acid (contains varying aMounts of Anhydride)
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CAS No:
4-Chloro-3-(trifluoromethyl)phenylboronic acid Basic Attributes
224.37
224.002319
DTXSID50382202
29319090
Characteristics
40.5
1.49±0.1 g/cm3(Predicted)
135-137 °C(lit.)
304.3±52.0 °C(Predicted)
137.8±30.7 °C
1.485
H2O: freely soluble
Safety Information
IRRITANT
36/37/38-36
26-36-37/39-24/25
Xi
Irritant
P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, P501
H315
|Warning|H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]|P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501|Aggregated GHS information provided by 9 companies from 5 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Computed Properties
Molecular Weight:224.37
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:1
Exact Mass:224.0023217
Monoisotopic Mass:224.0023217
Topological Polar Surface Area:40.5
Heavy Atom Count:14
Complexity:200
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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4-Chloro-3-(trifluoromethyl)phenylboronic acid
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