4,5-Difluoro-2-nitrobenzoic acid
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4,5-Difluoro-2-nitrobenzoic acid
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CAS No:
20372-63-8
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Formula:
C7H3F2NO4
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Chemical Name:
4,5-Difluoro-2-nitrobenzoic acid
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Synonyms:
Benzoic acid,4,5-difluoro-2-nitro-;4,5-Difluoro-2-nitrobenzoic acid;2-Nitro-4,5-difluorobenzoic acid;3,4-Difluoro-6-nitrobenzoic acid
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CAS No:
4,5-Difluoro-2-nitrobenzoic acid Basic Attributes
203.1
203.10
1533716-785-6
DTXSID80400963
2916399090
Characteristics
83.12000
2.09440
powder
1.661±0.06 g/cm3
165-167 °C (lit.)
349.7±42.0 °C(Predicted)
165.3ºC
1.563
1.73E-05mmHg at 25°C
1.85±0.25
Safety Information
IRRITANT
3
36/37/38
26
Xi
|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|The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.|Aggregated GHS information provided by 47 companies from 6 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Computed Properties
Molecular Weight:203.10
XLogP3:1.7
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:1
Exact Mass:203.00301390
Monoisotopic Mass:203.00301390
Topological Polar Surface Area:83.1
Heavy Atom Count:14
Complexity:255
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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