3,5-Bis(trifluoromethyl)phenylacetic acid
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3,5-Bis(trifluoromethyl)phenylacetic acid
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CAS No:
85068-33-3
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Formula:
C10H6F6O2
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Chemical Name:
3,5-Bis(trifluoromethyl)phenylacetic acid
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Synonyms:
Benzeneacetic acid,3,5-bis(trifluoromethyl)-;3,5-Bis(trifluoromethyl)benzeneacetic acid;3,5-Bis(trifluoromethyl)phenylacetic acid;2-(3,5-Ditrifluoromethylphenyl)acetic acid;2-(3,5-Bis(trifluoromethyl)phenyl)acetic acid;2-[3,5-Bis(trifluoromethyl)phenyl]acetic acid
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CAS No:
3,5-Bis(trifluoromethyl)phenylacetic acid Basic Attributes
272.14
272.14
6813447
285-295-6
YW9DB76S84
DTXSID10234137
2916399090
Characteristics
37.3
2.93
White solid
1.5±0.1 g/cm3
121-123 °C(lit.)
227.7±35.0 °C at 760 mmHg
91.5±25.9 °C
1.428
methanol: soluble 25mg/mL, clear, colorless
Store in a cool, dry place. Store in a tightly closed container.
Safety Information
IRRITANT
NONH for all modes of transport
3
36/37/38
26-36-37/39
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 45 companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Computed Properties
Molecular Weight:272.14
XLogP3:3.2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:2
Exact Mass:272.02719840
Monoisotopic Mass:272.02719840
Topological Polar Surface Area:37.3
Heavy Atom Count:18
Complexity:287
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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3,5-Bis(trifluoromethyl)phenylacetic acid
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