2-[2,3-bis(sulfanyl)propylcarbamoyl]benzoic acid
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![2-[2,3-bis(sulfanyl)propylcarbamoyl]benzoic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/3b047cc620984dcda32bd626df840dcb.png "2-[2,3-bis(sulfanyl)propylcarbamoyl]benzoic acid")
2-[2,3-bis(sulfanyl)propylcarbamoyl]benzoic acid
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CAS No:
13312-78-2
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Formula:
C11H13NO3S2
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Chemical Name:
2-[2,3-bis(sulfanyl)propylcarbamoyl]benzoic acid
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Synonyms:
2,3-DPPA;2-(((2,3-dimercaptopropyl)amino)carbonyl)benzoic acid;N-(2,3-dimercaptopropyl)phthalamidic acid;2-[2,3-bis(sulfanyl)propylcarbamoyl]benzoic acid;13312-78-2;BRN 2587156;N-(2,3-Dimercaptopropyl)phthalamic acid;N-(2,3-Dimercaptopropyl)phthalamidic acid;Phthalic acid N-(2,3-dimercaptopropyl)monoamide;2-((2,3-(Dimercaptopropyl)amino)carbonyl)benzoic acid;Phthalamic acid, N-(2,3-dimercaptopropyl)-;SCHEMBL3422289;DTXSID10927951;N-(2,3-dimercaptopropyl) phthalamidic acid;Q26840955;2-(((2,3-dimercaptopropyl)amino)carbonyl)benzoic acid;2-[{[2,3-Bis(sulfanyl)propyl]imino}(hydroxy)methyl]benzoic acid;Benzoic acid, 2-((2,3-(dimercaptopropyl)amino)carbonyl)- (9CI)
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CAS No:
Computed Properties
Molecular Weight:271.4
XLogP3:1.4
Hydrogen Bond Donor Count:4
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:5
Exact Mass:271.03368562
Monoisotopic Mass:271.03368562
Topological Polar Surface Area:68.4
Heavy Atom Count:17
Complexity:286
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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