3-(9H-Purin-6-ylthio)propanoic acid
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3-(9H-Purin-6-ylthio)propanoic acid
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CAS No:
608-10-6
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Formula:
C8H8N4O2S
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Chemical Name:
3-(9H-Purin-6-ylthio)propanoic acid
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Synonyms:
Propanoic acid,3-(9H-purin-6-ylthio)-;Propionic acid,3-(purinylthio)-;Propanoic acid,3-(1H-purin-6-ylthio)-;Propionic acid,3-(purin-6-ylthio)-;3-(9H-Purin-6-ylthio)propanoic acid;6-(2-Carboxyethylthio)purine;NSC 22242
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CAS No:
3-(9H-Purin-6-ylthio)propanoic acid Basic Attributes
224.24 g/mol
224.24
U5WO03O9P8
22242
DTXSID20209639
Safety Information
|Warning|H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]|P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501|The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Computed Properties
Molecular Weight:224.24
XLogP3:0.9
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:4
Exact Mass:224.03679668
Monoisotopic Mass:224.03679668
Topological Polar Surface Area:117
Heavy Atom Count:15
Complexity:241
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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