5-[9-[(3-carboxy-4-nitrophenyl)disulfanyl]nonyldisulfanyl]-2-nitrobenzoic acid
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![5-[9-[(3-carboxy-4-nitrophenyl)disulfanyl]nonyldisulfanyl]-2-nitrobenzoic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/1120a03b2c494c89a8bae32937d8a58f.png "5-[9-[(3-carboxy-4-nitrophenyl)disulfanyl]nonyldisulfanyl]-2-nitrobenzoic acid")
5-[9-[(3-carboxy-4-nitrophenyl)disulfanyl]nonyldisulfanyl]-2-nitrobenzoic acid
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CAS No:
142093-99-0
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Formula:
C23H26N2O8S4
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Chemical Name:
5-[9-[(3-carboxy-4-nitrophenyl)disulfanyl]nonyldisulfanyl]-2-nitrobenzoic acid
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Synonyms:
NBDN;
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CAS No:
5-[9-[(3-carboxy-4-nitrophenyl)disulfanyl]nonyldisulfanyl]-2-nitrobenzoic acid Basic Attributes
586.72100
586.05720049 g/mol
DTXSID40161942
Computed Properties
Molecular Weight:586.7
XLogP3:6.5
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:12
Rotatable Bond Count:16
Exact Mass:586.05720049
Monoisotopic Mass:586.05720049
Topological Polar Surface Area:267
Heavy Atom Count:37
Complexity:691
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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