AG003473

1187933-06-7 | tert-Butyl hexahydro-1H-pyrrolo[3,4-c]pyridine-5(6H)-carboxylate hydrochloride

AG003473

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CAS Number	1187933-06-7
Catalog Number	AG003473(AGN-PC-0BLDOU)
Chemical Name	tert-Butyl hexahydro-1H-pyrrolo[3,4-c]pyridine-5(6H)-carboxylate hydrochloride
IUPAC Name	tert-butyl 1,2,3,3a,4,6,7,7a-octahydropyrrolo[3,4-c]pyridine-5-carboxylate;hydrochloride
InChI	InChI=1S/C12H22N2O2.ClH/c1-12(2,3)16-11(15)14-5-4-9-6-13-7-10(9)8-14;/h9-10,13H,4-8H2,1-3H3;1H
InChI Key	YSYTUDUBRMMISQ-UHFFFAOYSA-N
MDL Number	MFCD12913817
Molecular Formula	C12H23ClN2O2
Molecular Weight	262.7762
SMILES	Cl.C1NCC2CN(CCC21)C(=O)OC(C)(C)C
Synonyms	1187933-06-7, tert-Butyl hexahydro-1H-pyrrolo[3,4-c]pyridine-5(6H)-carboxylate hydrochloride, 5-Boc-octahydropyrrolo[3,4-c]pyridine Hydrochloride, 5-Boc-octahydropyrrolo[3,4-c]pyridine HCl, AK-77570, tert-butyl octahydro-5H-pyrrolo[3,4-c]pyridine-5-carboxylate hydrochloride, CTK8B9939, DTXSID50719933, KS-00000E8W, 3134AA, ANW-63678, MFCD12913817, WT1227, AKOS016003603, TRA0137995, AC-29342, DS-17177, SY021056, AX8222684, TC-152423, CS-0047879, S-7884, MFCD12913817 (95+%), 5-Boc-octahydropyrrolo[3,4-c]pyridineHydrochloride, tert-Butyl hexahydro-1h-pyrrolo[3,4-c]pyridine-5(6h)-carboxylate HCl, Octahydro-5H-pyrrolo[3,4-c]pyridine-5-carboxylic acid 1,1-dimethylethyl ester hydrochloride, Octahydro-pyrrolo[3,4-c]pyridine-5-carboxylic acid tert-butyl ester hydrochloride, tert-butyl 1,2,3,3a,4,6,7,7a-octahydropyrrolo[3,4-c]pyridine-5-carboxylate;hydrochloride, tert-Butyl octahydro-5H-pyrrolo[3,4-c]pyridine-5-carboxylate--hydrogen chloride (1/1), 351370-99-5 tert-butyl hexahydro-1H-pyrrolo[3,4-c]pyridine-5(6H)-carboxylate hydrochloride, C12H23ClN2O2, YSYTUDUBRMMISQ-UHFFFAOYSA-N, tert-butyl octahydro-1H-pyrrolo[3,4-c]pyridine-5-carboxylate hydrochloride, 351370-99-5,

Complexity	273
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	2
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	262.145g/mol
Formal Charge	0
Heavy Atom Count	17
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	262.778g/mol
Monoisotopic Mass	262.145g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	41.6A^2
Undefined Atom Stereocenter Count	2
Undefined Bond Stereocenter Count	0

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H332-H335
Packing Group
Precautionary statements	P261-P280-P305+P351+P338
UN Code

Certificate of Analysis

Lot Number