[2-(4-iodo-2-methylanilino)-2-oxoethyl] 5-nitrothiophene-2-carboxylate
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[2-(4-iodo-2-methylanilino)-2-oxoethyl] 5-nitrothiophene-2-carboxylate
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CAS No:
731001-09-5
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Formula:
C14H11IN2O5S
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Chemical Name:
[2-(4-iodo-2-methylanilino)-2-oxoethyl] 5-nitrothiophene-2-carboxylate
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Synonyms:
ZINC3288195;AKOS033686719;MCULE-6395596364;SR-01000047645;SR-01000047645-1;Z19502248;[(4-iodo-2-methylphenyl)carbamoyl]methyl 5-nitrothiophene-2-carboxylate;731001-09-5
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CAS No:
[2-(4-iodo-2-methylanilino)-2-oxoethyl] 5-nitrothiophene-2-carboxylate Basic Attributes
446.22 g/mol
445.94334 g/mol
Computed Properties
Molecular Weight:446.22
XLogP3:3.9
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:5
Exact Mass:445.94334
Monoisotopic Mass:445.94334
Topological Polar Surface Area:130
Heavy Atom Count:23
Complexity:473
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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