(2R,3aR,7aR)-Octahydro-1H-indole-2-carboxylic acid
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(2R,3aR,7aR)-Octahydro-1H-indole-2-carboxylic acid
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CAS No:
108507-42-2
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Formula:
C9H15NO2
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Chemical Name:
(2R,3aR,7aR)-Octahydro-1H-indole-2-carboxylic acid
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Synonyms:
1H-Indole-2-carboxylic acid,octahydro-,(2R,3aR,7aR)-;1H-Indole-2-carboxylic acid,octahydro-,[2R-(2α,3aβ,7aβ)]-;(2R,3aR,7aR)-Octahydro-1H-indole-2-carboxylic acid
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CAS No:
(2R,3aR,7aR)-Octahydro-1H-indole-2-carboxylic acid Basic Attributes
169.22100
169.22
600-874-9
2933990090
Computed Properties
Molecular Weight:169.22
XLogP3:-1
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:1
Exact Mass:169.110278721
Monoisotopic Mass:169.110278721
Topological Polar Surface Area:49.3
Heavy Atom Count:12
Complexity:193
Undefined Atom Stereocenter Count:3
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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