2-Methyl-4-nitrobenzoic acid
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2-Methyl-4-nitrobenzoic acid
structure -
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CAS No:
1975-51-5
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Formula:
C8H7NO4
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Chemical Name:
2-Methyl-4-nitrobenzoic acid
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Synonyms:
Benzoic acid,2-methyl-4-nitro-;o-Toluic acid,4-nitro-;2-Methyl-4-nitrobenzoic acid;4-Nitro-2-methylbenzoic acid;4-Nitro-o-toluic acid;NSC 227948
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CAS No:
2-Methyl-4-nitrobenzoic acid Basic Attributes
181.15
181.03750770
217-828-5
227948
DTXSID90173434
29163100
Safety Information
|Warning|H302 (85.11%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P271, P272, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P333+P313, P337+P313, P362, P363, P403+P233, P405, and P501|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:181.15
XLogP3:1.6
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:1
Exact Mass:181.03750770
Monoisotopic Mass:181.03750770
Topological Polar Surface Area:83.1
Heavy Atom Count:13
Complexity:223
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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