1-[4-Amino-2-methyl-5-(4-methylphenyl)-1H-pyrrol-3-yl]ethanone
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![1-[4-Amino-2-methyl-5-(4-methylphenyl)-1H-pyrrol-3-yl]ethanone structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/732776d569f64e428480c1e5af0241a6.png "1-[4-Amino-2-methyl-5-(4-methylphenyl)-1H-pyrrol-3-yl]ethanone")
1-[4-Amino-2-methyl-5-(4-methylphenyl)-1H-pyrrol-3-yl]ethanone
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CAS No:
56463-61-7
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Formula:
C14H16N2O
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Chemical Name:
1-[4-Amino-2-methyl-5-(4-methylphenyl)-1H-pyrrol-3-yl]ethanone
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Synonyms:
1-(4-Amino-2-methyl-5-(4-methylphenyl)-1H-pyrrol-3-yl)ethanone;ETHANONE, 1-(4-AMINO-2-METHYL-5-(4-METHYLPHENYL)-1H-PYRROL-3-YL)-;1-[4-amino-2-methyl-5-(4-methylphenyl)-1H-pyrrol-3-yl]ethanone;BRN 0477627;Ketone, (4-amino-2-methyl-5-(p-tolyl)pyrrol-3-yl) methyl;SCHEMBL11452791;CTK3I9325;DTXSID20205010
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CAS No:
1-[4-Amino-2-methyl-5-(4-methylphenyl)-1H-pyrrol-3-yl]ethanone Basic Attributes
228.295
228.126
DTXSID20205010
Characteristics
58.9
2.7
1.0604 (rough estimate)
232-234 °C(Solv: methanol (67-56-1))
Oral-Mouse LD50: 1000 mg/kg
Flammable; burning produces toxic nitrogen oxide fumes
Computed Properties
Molecular Weight:228.29
XLogP3:2.7
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:2
Exact Mass:228.126263138
Monoisotopic Mass:228.126263138
Topological Polar Surface Area:58.9
Heavy Atom Count:17
Complexity:284
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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