tert-butyl (3aR,7aR)-1,2,3,3a,4,6,7,7a-octahydropyrrolo[3,4-c]pyridine-5-carboxylate
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![tert-butyl (3aR,7aR)-1,2,3,3a,4,6,7,7a-octahydropyrrolo[3,4-c]pyridine-5-carboxylate structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/3224ebbd985e4a7bb376967b7b607c43.png "tert-butyl (3aR,7aR)-1,2,3,3a,4,6,7,7a-octahydropyrrolo[3,4-c]pyridine-5-carboxylate")
tert-butyl (3aR,7aR)-1,2,3,3a,4,6,7,7a-octahydropyrrolo[3,4-c]pyridine-5-carboxylate
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CAS No:
1273568-65-2
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Formula:
C12H22N2O2
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Chemical Name:
tert-butyl (3aR,7aR)-1,2,3,3a,4,6,7,7a-octahydropyrrolo[3,4-c]pyridine-5-carboxylate
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Synonyms:
1273568-65-2;trans-tert-Butyl hexahydro-1H-pyrrolo[3,4-c]pyridine-5(6H)-carboxylate;tert-Butyl (3aR,7aR)-octahydro-5H-pyrrolo[3,4-c]pyridine-5-carboxylate;(3aR,7aR)-tert-Butyl hexahydro-1H-pyrrolo[3,4-c]pyridine-5(6H)-carboxylate;DTXSID90364042;ZINC4203953;(3aR,7aR)-5-Boc-octahydro-pyrrolo[3,4-c]pyridine;(3aR,7aR)-5-Boc-octahydropyrrolo[3,4-c]pyridine
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CAS No:
tert-butyl (3aR,7aR)-1,2,3,3a,4,6,7,7a-octahydropyrrolo[3,4-c]pyridine-5-carboxylate Basic Attributes
226.32 g/mol
226.168127949 g/mol
DTXSID90364042
Safety Information
|Warning|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P264, P270, P301+P312, P330, and P501|The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Computed Properties
Molecular Weight:226.32
XLogP3:1.1
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
Defined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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