AG007NUP

252720-32-4 | 4-N-BOC-AMINO-1-CBZ-ISONIPECOTIC ACID

AG007NUP

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CAS Number	252720-32-4
Catalog Number	AG007NUP(AGN-PC-03YVV0)
Chemical Name	4-N-BOC-AMINO-1-CBZ-ISONIPECOTIC ACID
IUPAC Name	4-[(2-methylpropan-2-yl)oxycarbonylamino]-1-phenylmethoxycarbonylpiperidine-4-carboxylic acid
InChI	InChI=1S/C19H26N2O6/c1-18(2,3)27-16(24)20-19(15(22)23)9-11-21(12-10-19)17(25)26-13-14-7-5-4-6-8-14/h4-8H,9-13H2,1-3H3,(H,20,24)(H,22,23)
InChI Key	BGRHKAAVXJAPGP-UHFFFAOYSA-N
MDL Number	MFCD03425219
Molecular Formula	C19H26N2O6
Molecular Weight	378.4195
SMILES	O=C(O)C1(NC(OC(C)(C)C)=O)CCN(C(OCC2=CC=CC=C2)=O)CC1
Synonyms	3-hydroxycezomycin, AC 7230, AC-7230, AC7230, 252720-32-4, 4-n-boc-amino-1-cbz-isonipecotic acid, 4-(Boc-amino)-1-Cbz-piperidine-4-carboxylic Acid, 1-((benzyloxy)carbonyl)-4-((tert-butoxycarbonyl)amino)piperidine-4-carboxylic acid, 4-tert-butoxycarbonylamino-piperidine-1,4-dicarboxylic acid monobenzyl ester, 4-boc-amino-1-cbz-piperidine-4-carboxylic acid, 1-[(BENZYLOXY)CARBONYL]-4-[(TERT-BUTOXYCARBONYL)AMINO]PIPERIDINE-4-CARBOXYLIC ACID, 4-N-Boc-amino-1-Cbz-piperidine-4-carboxylic acid, 1-benzyloxycarbonyl-4-(t-butoxycarbonylamino)piperidin-4-carboxylic acid, 4-tert-butoxycarbonylaminopiperidine-1,4-dicarboxylic acid monobenzyl ester, 4-[(2-methylpropan-2-yl)oxycarbonylamino]-1-phenylmethoxycarbonylpiperidine-4-carboxylic acid, boc-pip(z)-oh, PubChem23392, 4-N-Boc-Amino-1-Cbz-piperidine-4-carboxylicacid, SCHEMBL1147365, CTK4F5350, DTXSID30630576, BGRHKAAVXJAPGP-UHFFFAOYSA-N, ACT05188, CS-D0689, MFCD03425219, ZINC12648497, AKOS007930600, AB14580, AC-7230, AN-9179, CB-3604, FCH2718712, AJ-62771, AK-27104, AS-36655, BR-27104, EN002571, OR312141, SY005262, AB0023727, AB1000408, AX8028177, RT-009802, ST2418502, 4CH-012898, FT-0630237, W4855, S-3437, MFCD03425219 (95+%), 720B324, I14-11321, 4-Boc-amino-1-Cbz-piperidine-4-carboxylic acid, AldrichCPR, 1-(benzyloxycarbonyl)-4-(tert-butoxycarbonyl)piperidine-4-carboxylic, 1-(benzyloxycarbonyl)-4-(tert-butoxycarbonyl)piperidine-4-carboxylic acid, 1-benzyloxycarbonyl-4-(tert-butoxycarbonylamino)piperidine-4-carboxylic acid, 1-(benzyloxycarbonyl)-4-(tert-butoxycarbonylamino)piperidine-4-carboxylic acid, 1-[(benzyloxy)carbonyl]-4-{[(tert-butoxy)carbonyl]amino}piperidine-4-carboxylic acid, 1,4-Piperidinedicarboxylicacid, 4-[[(1,1-dimethylethoxy)carbonyl]amino]-, 1-(phenylmethyl) ester, null, C19H26N2O6, A13739,

Complexity	543
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	378.179g/mol
Formal Charge	0
Heavy Atom Count	27
Hydrogen Bond Acceptor Count	6
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	378.425g/mol
Monoisotopic Mass	378.179g/mol
Rotatable Bond Count	7
Topological Polar Surface Area	105A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.3

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

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