3-(1H-INDOL-3-YLSULFANYL)-PROPIONICACID
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3-(1H-INDOL-3-YLSULFANYL)-PROPIONICACID
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CAS No:
80412-20-0
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Formula:
C11H11NO2S
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Chemical Name:
3-(1H-INDOL-3-YLSULFANYL)-PROPIONICACID
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Synonyms:
3-(1H-indol-3-ylsulfanyl)propanoic Acid;3-(1H-Indol-3-ylsulfanyl)-propionic acid;Propanoic acid,3-(1H-indol-3-ylthio)-;3-(1H-INDOL-3-YLSULFANYL)-PROPIONICACID;Oprea1_649839;Oprea1_871419;3-indol-3-ylthiopropanoic acid;SCHEMBL10857234;CTK5E7753;DTXSID10355194
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CAS No:
3-(1H-INDOL-3-YLSULFANYL)-PROPIONICACID Basic Attributes
221.27600
221.05100
DTXSID10355194
2933990090
Characteristics
78.39000
2.73470
1.36±0.1 g/cm3(Predicted)
176 °C(Solv: benzene (71-43-2))
478ºC at 760 mmHg
242.9ºC
Computed Properties
Molecular Weight:221.28
XLogP3:1.7
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:4
Exact Mass:221.05104977
Monoisotopic Mass:221.05104977
Topological Polar Surface Area:78.4
Heavy Atom Count:15
Complexity:235
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
3-(1H-INDOL-3-YLSULFANYL)-PROPIONICACID
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