2-acetamido-3-[1-(2-chlorophenyl)-3-oxononyl]sulfanylpropanoic acid
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![2-acetamido-3-[1-(2-chlorophenyl)-3-oxononyl]sulfanylpropanoic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/f6d19259e6044f418518e07b8a0ebae5.png "2-acetamido-3-[1-(2-chlorophenyl)-3-oxononyl]sulfanylpropanoic acid")
2-acetamido-3-[1-(2-chlorophenyl)-3-oxononyl]sulfanylpropanoic acid
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CAS No:
115887-23-5
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Formula:
C20H28ClNO4S
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Chemical Name:
2-acetamido-3-[1-(2-chlorophenyl)-3-oxononyl]sulfanylpropanoic acid
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Synonyms:
2-(N-acetylamino)-3-(1-(2-chlorophenyl)-3-oxononylthio)propionate;AACPONTP;Aacpontp;115887-23-5;DTXSID90921831;NSC376284;NSC-376284;DL-Cysteine, N-acetyl-S-(1-(2-chlorophenyl)-3-oxononyl)-;2-(N-Acetylamino)-3-(1-(2-chlorophenyl)-3-oxononylthio)propionate;S-[1-(2-Chlorophenyl)-3-oxononyl]-N-(1-hydroxyethylidene)cysteine
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CAS No:
2-acetamido-3-[1-(2-chlorophenyl)-3-oxononyl]sulfanylpropanoic acid Basic Attributes
414.0 g/mol
413.1427572 g/mol
376284
Computed Properties
Molecular Weight:414.0
XLogP3:4.1
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:13
Exact Mass:413.1427572
Monoisotopic Mass:413.1427572
Topological Polar Surface Area:109
Heavy Atom Count:27
Complexity:489
Undefined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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