3,5-Difluorophenylacetic acid
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3,5-Difluorophenylacetic acid
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CAS No:
105184-38-1
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Formula:
C8H6F2O2
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Chemical Name:
3,5-Difluorophenylacetic acid
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Synonyms:
3,5-DIFLUOROPHENYLACETIC ACID;2-(3,5-DIFLUOROPHENYL)ACETIC ACID;RARECHEM AL BO 0631;TIMTEC-BB SBB006660;3,5-Difluorophenylacetic acid 99%;3,5-Difluorophenylaceticacid99%;3,5-Difluorophenylac;3,5-Difluorobenzeneaceticacid
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CAS No:
Characteristics
37.3
1.6
1.3010 (estimate)
68-70 °C(lit.)
219°C (rough estimate)
102.0±23.2 °C
1.508
Safety Information
IRRITANT
NONH for all modes of transport
3
36/37/38
26-36-36/37/39-22-22/26/36/37/39
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 50 companies from 7 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Computed Properties
Molecular Weight:172.13
XLogP3:1.6
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:2
Exact Mass:172.03358575
Monoisotopic Mass:172.03358575
Topological Polar Surface Area:37.3
Heavy Atom Count:12
Complexity:162
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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