3,4,5-Trimethoxy-2-nitrobenzoic acid
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3,4,5-Trimethoxy-2-nitrobenzoic acid
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CAS No:
66907-52-6
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Formula:
C10H11NO7
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Chemical Name:
3,4,5-Trimethoxy-2-nitrobenzoic acid
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Synonyms:
Benzoic acid,3,4,5-trimethoxy-2-nitro-;3,4,5-Trimethoxy-2-nitrobenzoic acid;2-Nitro-3,4,5-trimethoxybenzoic acid;NSC 100936
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CAS No:
3,4,5-Trimethoxy-2-nitrobenzoic acid Basic Attributes
257.19700
257.20
266-518-6
100936
DTXSID60217056
2918990090
Characteristics
110.81000
1.84200
1.384g/cm3
163-164 °C @ Solvent: Benzene
440ºC
219.9ºC
>38.6 [ug/mL]
Safety Information
|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 38 companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Computed Properties
Molecular Weight:257.20
XLogP3:1.2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:4
Exact Mass:257.05355169
Monoisotopic Mass:257.05355169
Topological Polar Surface Area:111
Heavy Atom Count:18
Complexity:316
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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