AG00IJ5B

955016-25-8 | (2S,4R)-1-(tert-Butoxycarbonyl)-4-hydroxyhexahydro-2-pyridinecarboxylic acid

AG00IJ5B

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CAS Number	955016-25-8
Catalog Number	AG00IJ5B(AGN-PC-0OO4YD)
Chemical Name	(2S,4R)-1-(tert-Butoxycarbonyl)-4-hydroxyhexahydro-2-pyridinecarboxylic acid
IUPAC Name	(2S,4R)-4-hydroxy-1-[(2-methylpropan-2-yl)oxycarbonyl]piperidine-2-carboxylic acid
InChI	InChI=1S/C11H19NO5/c1-11(2,3)17-10(16)12-5-4-7(13)6-8(12)9(14)15/h7-8,13H,4-6H2,1-3H3,(H,14,15)/t7-,8+/m1/s1
InChI Key	GCAZZUFIDGXTDA-SFYZADRCSA-N
MDL Number	MFCD04112667
Molecular Formula	C11H19NO5
Molecular Weight	245.2723
SMILES	O=C([C@H]1N(C(OC(C)(C)C)=O)CC[C@@H](O)C1)O
Synonyms	(2S,4R)-1-(tert-Butoxycarbonyl)-4-hydroxypiperidine-2-carboxylic acid, 955016-25-8, (2S,4R)-1-(tert-Butoxycarbonyl)-4-hydroxyhexahydro-2-pyridinecarboxylic acid, AC1MBSIY, PubChem16279, SCHEMBL15174416, GCAZZUFIDGXTDA-SFYZADRCSA-N, KS-000024UJ, ZINC6882647, ANW-22788, MFCD04112667, SBB099994, (2S,4R)-1-[(tert-butoxy)carbonyl]-4-hydroxypiperidine-2-carboxylic acid, AKOS005256757, AKOS015892188, EE-0206, FCH3600256, FCH3924831, OR42166, OR51946, RP13997, AJ-56991, AX8230377, TR-029802, ST24020286, V9619, B-7475, Boc-(2S,4R)-4-hydroxypiperidine-2-carboxylic acid, I02-4181, J-501039, tertbutoxycarbonylhydroxyhexahydropyridinecarboxylicacid, (2S,4R)-Boc-4-hydroxypiperidine-2-carboxylic acid, AldrichCPR, CIS-4-hydroxy-piperidine-1,2-dicarboxylic acid 1-tert-butyl ester, (2S,4R)-1-[(tert-butyl)oxycarbonyl]-4-hydroxypiperidine-2-carboxylic acid, (2S,4R)-4-hydroxy-1-[(2-methylpropan-2-yl)oxycarbonyl]piperidine-2-carboxylic acid, C11H19NO5, CID2755980, (2R,4S)-4-hydroxypiperidine-2-carboxylic acid, 175671-49-5, 1-(tert-Butoxycarbonyl)-4-hydroxypiperidine-2-carboxylic acid, 4-hydroxy-1-[(2-methylpropan-2-yl)oxycarbonyl]piperidine-2-carboxylic Acid, 917835-93-9,

Complexity	310
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	2
Defined Bond Stereocenter Count	0
Exact Mass	245.126g/mol
Formal Charge	0
Heavy Atom Count	17
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	245.275g/mol
Monoisotopic Mass	245.126g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	87.1A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.6

GHS Hazard and Precautionary Statements

Symbol:
Hazard statements	H302-H312-H315-H319-H332-H335
Precuationary statements	P261-P280-P305+P351+P338
Siginal words

Certificate of Analysis

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