1,1-Dimethylethyl octahydro-1H-pyrrolo[3,4-b]pyridine-1-carboxylate
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![1,1-Dimethylethyl octahydro-1H-pyrrolo[3,4-b]pyridine-1-carboxylate structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/36e6a346ba4c467b8b30979c73f2d97c.png "1,1-Dimethylethyl octahydro-1H-pyrrolo[3,4-b]pyridine-1-carboxylate")
1,1-Dimethylethyl octahydro-1H-pyrrolo[3,4-b]pyridine-1-carboxylate
structure -
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CAS No:
159877-36-8
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Formula:
C12H22N2O2
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Chemical Name:
1,1-Dimethylethyl octahydro-1H-pyrrolo[3,4-b]pyridine-1-carboxylate
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Synonyms:
1H-Pyrrolo[3,4-b]pyridine-1-carboxylic acid,octahydro-,1,1-dimethylethyl ester;1,1-Dimethylethyl octahydro-1H-pyrrolo[3,4-b]pyridine-1-carboxylate;Octahydropyrrolo[3,4-b]pyridine-1-carboxylic acid tert-butyl ester;tert-Butyl octahydro-1H-pyrrolo[3,4-b]pyridine-1-carboxylate;1-Boc-Octahydropyrrolo[3,4-b]pyridine
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CAS No:
1,1-Dimethylethyl octahydro-1H-pyrrolo[3,4-b]pyridine-1-carboxylate Basic Attributes
226.32
226.32
605-192-5
DTXSID00626486
2933990090
Safety Information
|Danger|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P310, P312, P321, P330, P332+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:226.32
XLogP3:1.3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:2
Exact Mass:226.168127949
Monoisotopic Mass:226.168127949
Topological Polar Surface Area:41.6
Heavy Atom Count:16
Complexity:273
Undefined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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1,1-Dimethylethyl octahydro-1H-pyrrolo[3,4-b]pyridine-1-carboxylate
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