2-Bromo-3,6-difluorobenzoic acid
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2-Bromo-3,6-difluorobenzoic acid
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CAS No:
124244-65-1
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Formula:
C7H3BrF2O2
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Chemical Name:
2-Bromo-3,6-difluorobenzoic acid
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Synonyms:
2-Bromo-3,6-difluorobenzoic acid;SCHEMBL17007116;2-Bromo-3,6-fluorobenzoic acid;CTK7B9590;ZINC40571919;AKOS022177187;CM12475;JS-5122;Z1779
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CAS No:
Characteristics
37.3
2.35
1.872±0.06 g/cm3(Predicted)
111-113 °C(Solv: heptane (142-82-5))
281.8±40.0 °C(Predicted)
124.2±27.3 °C
1.559
Safety Information
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 2 companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Computed Properties
Molecular Weight:237.00
XLogP3:2.3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:1
Exact Mass:235.92845
Monoisotopic Mass:235.92845
Topological Polar Surface Area:37.3
Heavy Atom Count:12
Complexity:188
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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2-Bromo-3,6-difluorobenzoic acid
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