2-methylpropyl 4-nitrobenzoate
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2-methylpropyl 4-nitrobenzoate
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CAS No:
99-78-5
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Formula:
C11H13NO4
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Chemical Name:
2-methylpropyl 4-nitrobenzoate
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Synonyms:
p-Nitrobenzoic acid, isobutyl ester;2-methylpropyl 4-nitrobenzoate;Isobutyl p-nitrobenzoate;Isobutyl 4-nitrobenzoate;Benzoic acid, p-nitro-, isobutyl ester;99-78-5;Q63392595;Isobutyl 4-nitrobenzoate #;SCHEMBL10439554;ZINC80719;DTXSID10283862;4-Nitrobenzoic acid isobutyl ester;NSC33845;NSC-33845;AKOS002270826;MCULE-9361377553;4-Nitrobenzoic acid, 2-methylpropyl ester;PARA-NITROBENZOIC ACID ISOBUTYL ESTER;ST50186294;Benzoic acid, 4-nitro-, 2-methylpropyl ester
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CAS No:
2-methylpropyl 4-nitrobenzoate Basic Attributes
223.22 g/mol
223.08445790 g/mol
33845
DTXSID10283862
Computed Properties
Molecular Weight:223.22
XLogP3:3.3
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:4
Exact Mass:223.08445790
Monoisotopic Mass:223.08445790
Topological Polar Surface Area:72.1
Heavy Atom Count:16
Complexity:251
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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