3-(Aminosulfonyl)-5-nitro-4-phenoxybenzoic acid
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3-(Aminosulfonyl)-5-nitro-4-phenoxybenzoic acid
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CAS No:
28328-53-2
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Formula:
C13H10N2O7S
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Chemical Name:
3-(Aminosulfonyl)-5-nitro-4-phenoxybenzoic acid
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Synonyms:
Benzoic acid,3-(aminosulfonyl)-5-nitro-4-phenoxy-;Benzoic acid,3-nitro-4-phenoxy-5-sulfamoyl-;3-(Aminosulfonyl)-5-nitro-4-phenoxybenzoic acid;3-Nitro-4-phenoxy-5-sulfamoylbenzoic acid
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CAS No:
3-(Aminosulfonyl)-5-nitro-4-phenoxybenzoic acid Basic Attributes
338.2927
338.29
248-970-6
2935009090
Characteristics
161
1.81
1.6±0.1 g/cm3
251-253°C (dec.)
547.6±60.0 °C at 760 mmHg
285.0±32.9 °C
1.651
Refrigerator
7.95E-13mmHg at 25°C
Safety Information
NONH for all modes of transport
|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 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
3-(Aminosulfonyl)-5-nitro-4-phenoxybenzoic acid Use and Manufacturing
Intermediate in the production of Bumetanide
Computed Properties
Molecular Weight:338.29
XLogP3:1.4
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:4
Exact Mass:338.02087184
Monoisotopic Mass:338.02087184
Topological Polar Surface Area:161
Heavy Atom Count:23
Complexity:548
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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3-(Aminosulfonyl)-5-nitro-4-phenoxybenzoic acid
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