Dihydrokainic acid
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Dihydrokainic acid
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CAS No:
52497-36-6
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Formula:
C10H17NO4
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Chemical Name:
Dihydrokainic acid
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Synonyms:
3-Pyrrolidineacetic acid,2-carboxy-4-(1-methylethyl)-,(2S,3S,4R)-;3-Pyrrolidineacetic acid,2-carboxy-4-(1-methylethyl)-,[2S-(2α,3β,4β)]-;(2S,3S,4R)-2-Carboxy-4-(1-methylethyl)-3-pyrrolidineacetic acid;Dihydrokainic acid;α-Dihydrokainic acid;59905-20-3
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CAS No:
Safety Information
|Warning|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P312, P322, P330, P363, and P501|Aggregated GHS information provided by 38 companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Computed Properties
Molecular Weight:215.25
XLogP3:-1.7
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:4
Exact Mass:215.11575802
Monoisotopic Mass:215.11575802
Topological Polar Surface Area:86.6
Heavy Atom Count:15
Complexity:264
Defined Atom Stereocenter Count:3
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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