1-[4-amino-5-(2-chlorophenyl)-2-methyl-1H-pyrrol-3-yl]ethanone
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![1-[4-amino-5-(2-chlorophenyl)-2-methyl-1H-pyrrol-3-yl]ethanone structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/a11ae7664dc34754bb33dbf398aaa0ed.png "1-[4-amino-5-(2-chlorophenyl)-2-methyl-1H-pyrrol-3-yl]ethanone")
1-[4-amino-5-(2-chlorophenyl)-2-methyl-1H-pyrrol-3-yl]ethanone
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CAS No:
91481-02-6
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Formula:
C13H13ClN2O
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Chemical Name:
1-[4-amino-5-(2-chlorophenyl)-2-methyl-1H-pyrrol-3-yl]ethanone
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Synonyms:
1-[4-amino-5-(2-chlorophenyl)-2-methyl-1H-pyrrol-3-yl]ethanone;1-(4-Amino-5-(2-chlorophenyl)-2-methyl-1H-pyrrol-3-yl)ethanone;ETHANONE, 1-(4-AMINO-5-(2-CHLOROPHENYL)-2-METHYL-1H-PYRROL-3-YL)-;Ketone, (4-amino-5-(o-chlorophenyl)-2-methylpyrrol-3-yl) methyl;CTK5G9699;DTXSID80238586;ZINC2013758;LS-67113;1-(4-Amino-5-(2-chlorophenyl)-2-methyl-1H-pyrrol-3-yl)ethan-1-one
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CAS No:
1-[4-amino-5-(2-chlorophenyl)-2-methyl-1H-pyrrol-3-yl]ethanone Basic Attributes
248.71
248.071641
DTXSID80238586
Characteristics
58.9
4.00950
1.2365 (rough estimate)
421.9ºC at 760 mmHg
209ºC
1.628
Oral-Mouse LD50: 500mg/kg
Flammable; burning produces toxic nitrogen oxides and chloride fumes
Computed Properties
Molecular Weight:248.71
XLogP3:3
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:2
Exact Mass:248.0716407
Monoisotopic Mass:248.0716407
Topological Polar Surface Area:58.9
Heavy Atom Count:17
Complexity:297
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
1-[4-amino-5-(2-chlorophenyl)-2-methyl-1H-pyrrol-3-yl]ethanone
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