AG00CG7E

219975-84-5 | 3S,4S-4-aminomethyl-3-hydroxy-piperidine-1-carboxylic acid tert-butyl ester

AG00CG7E

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CAS Number	219975-84-5
Catalog Number	AG00CG7E(AGN-PC-0QYJ05)
Chemical Name	3S,4S-4-aminomethyl-3-hydroxy-piperidine-1-carboxylic acid tert-butyl ester
IUPAC Name	tert-butyl (3S,4S)-4-(aminomethyl)-3-hydroxypiperidine-1-carboxylate
InChI	InChI=1S/C11H22N2O3/c1-11(2,3)16-10(15)13-5-4-8(6-12)9(14)7-13/h8-9,14H,4-7,12H2,1-3H3/t8-,9+/m0/s1
InChI Key	GAGALXYDHSHHCD-DTWKUNHWSA-N
MDL Number	MFCD11975907
Molecular Formula	C11H22N2O3
Molecular Weight	230.3040
SMILES	O=C(N1C[C@H](O)[C@@H](CN)CC1)OC(C)(C)C
Synonyms	trans-1-Boc-4-aminomethyl-3-hydroxypiperidine, 219975-84-5, 279247-20-0, tert-butyl (3S,4S)-4-(aminomethyl)-3-hydroxypiperidine-1-carboxylate, SCHEMBL857807, GAGALXYDHSHHCD-DTWKUNHWSA-N, 1932053-73-0, KS-000008KT, MFCD11975907, MFCD18381924, ZINC54957029, FCH3594601, FCH3997013, PB21269, SB20555, TERT-BUTYL (3S*,4S*)-4-(AMINOMETHYL)-3-HYDROXY-1-PIPERIDINECARBOXYLATE, AS-51300, CS-0048530, Q-4391, 4042226-25G, t-Butyl (3S,4S)-4-(aminomethyl)-3-hydroxypiperidine-1-carboxylate, tert-Butyl trans-4-(aminomethyl)-3-hydroxy-1-piperidinecarboxylate, (3S,4S)-tert-butyl 4-(aminomethyl)-3-hydroxypiperidine-1-carboxylate, 1,1-dimethylethyl (trans)-4-(aminomethyl)-3-hydroxy-1-piperidinecarboxylate, 1,1-dimethylethyl (trans)4-(aminomethyl)-3-hydroxy-1-piperidinecarboxylate, 1,1-dimethylethyl(trans)-4-(aminomethyl)-3-hydroxy-1-piperidine-carboxylate, 1,1-dimethylethyl(trans)-4-(aminomethyl)-3-hydroxy-1-piperidinecarboxylate, (+)-1,1-dimethylethyl (trans)-4-(aminomethyl)-3-hydroxy-1-piperidinecarboxylate, (+)-1,1-dimethylethyl(trans)-4-(aminomethyl)-3-hydroxy-1-piperidinecarboxylate, 1,1-dimethylethyl (3S-trans)-4-(aminomethyl)-3-hydroxy-1-piperidinecarboxylate, 1,1-dimethylethyl (3S-trans)4-(aminomethyl)-3-hydroxy-1-piperidinecarboxylate, 1,1-dimethylethyl (trans)-4-(aminomethyl)-3-hydroxy-1-piperidine-carboxylate, 1,1-dimethylethyl(3s-trans)-4-(aminomethyl)-3-hydroxy-1-piperidinecarboxylate, 1,1-dimethylethyl(3S-trans)4-(aminomethyl)-3-hydroxy-1-piperidinecarboxylate, CID11075229, (3R,4R)-tert-Butyl 4-(aminomethyl)-3-hydroxypiperidine-1-carboxylate, 3S,4S-4-aminomethyl-3-hydroxy-piperidine-1-carboxylicacidtert-butylester, Tert-butyl (3R,4S)-4-(aminomethyl)-3-hydroxy-piperidine-1-carboxylate,

Complexity	250
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	2
Defined Bond Stereocenter Count	0
Exact Mass	230.163g/mol
Formal Charge	0
Heavy Atom Count	16
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	230.308g/mol
Monoisotopic Mass	230.163g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	75.8A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.5

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

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