2,3,4,5,6-Pentafluorobenzeneacetic acid
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2,3,4,5,6-Pentafluorobenzeneacetic acid
structure -
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CAS No:
653-21-4
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Formula:
C8H3F5O2
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Chemical Name:
2,3,4,5,6-Pentafluorobenzeneacetic acid
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Synonyms:
Benzeneacetic acid,2,3,4,5,6-pentafluoro-;Acetic acid,(pentafluorophenyl)-;2,3,4,5,6-Pentafluorobenzeneacetic acid;(Pentafluorophenyl)acetic acid;2,3,4,5,6-Pentafluorophenylacetic acid;2-(Pentafluorophenyl)acetic acid;2-(2,3,4,5,6-Pentafluorophenyl)acetic acid;2-(Perfluorophenyl)acetic acid
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CAS No:
2,3,4,5,6-Pentafluorobenzeneacetic acid Basic Attributes
226.1
226.10
2056612
211-497-0
F2HFR5VJK7
DTXSID50215642
2916399090
Characteristics
37.3
1.69
1.6±0.1 g/cm3
109 °C
235.3±35.0 °C at 760 mmHg
96.1±25.9 °C
1.454
95% ethanol: soluble 50mg/mL, clear, colorless to very faintly yellow
Safety Information
IRRITANT
NONH for all modes of transport
3
36/37/38
26-36
Xi
Irritant
P261-P305 + P351 + P338
H315-H319-H335
|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 46 companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
2,3,4,5,6-Pentafluorobenzeneacetic acid Use and Manufacturing
Intermediate for medicine, pesticide, liquid crystal material.
Computed Properties
Molecular Weight:226.10
XLogP3:1.9
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:2
Exact Mass:226.00532014
Monoisotopic Mass:226.00532014
Topological Polar Surface Area:37.3
Heavy Atom Count:15
Complexity:233
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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2,3,4,5,6-Pentafluorobenzeneacetic acid
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