AG00494N

885049-08-1 | tert-Butyl 4-guanidinopiperidine-1-carboxylate hydrochloride

AG00494N

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CAS Number	885049-08-1
Catalog Number	AG00494N(AGN-PC-0VLX8W)
Chemical Name	tert-Butyl 4-guanidinopiperidine-1-carboxylate hydrochloride
IUPAC Name	tert-butyl 4-(diaminomethylideneamino)piperidine-1-carboxylate;hydrochloride
InChI	InChI=1S/C11H22N4O2.ClH/c1-11(2,3)17-10(16)15-6-4-8(5-7-15)14-9(12)13;/h8H,4-7H2,1-3H3,(H4,12,13,14);1H
InChI Key	HYZASXQVPHIDOS-UHFFFAOYSA-N
MDL Number	MFCD09999149
Molecular Formula	C11H23ClN4O2
Molecular Weight	278.7789
SMILES	Cl.O(C(C)(C)C)C(N1CCC(CC1)NC(N)=N)=O
Synonyms	885049-08-1, tert-Butyl 4-guanidinopiperidine-1-carboxylate hydrochloride, AK-24428, 1-BOC-4-[(AMINOIMINOMETHYL)AMINO]PIPERIDINE MONOHCL, tert-butyl 4-carbamimidamidopiperidine-1-carboxylate hydrochloride, HYZASXQVPHIDOS-UHFFFAOYSA-N, C11H23ClN4O2, DTXSID30671949, KS-00000HM6, MFCD09999149, AKOS015919472, BR-24428, DS-10582, FT-0648746, ST24031817, W9083, S-7264, 1-Boc-4-[(aminoiminomethyl)amino]piperidine mono, HCl, tert-butyl 4-guanidinopiperidine-1-carboxylate hydrochloride salt, tert-butyl 4-(diaminomethylideneamino)piperidine-1-carboxylate;hydrochloride, tert-Butyl 4-[(diaminomethylidene)amino]piperidine-1-carboxylate--hydrogen chloride (1/1), tert-butyl 4-{[(Z)-amino(imino)methyl]amino}piperidine-1-carboxylate hydrochloride, tert-butyl 4-{[amino(imino)methyl]amino}-piperidine-1-carboxylate hydrochloride, tert-butyl 4-{[amino(imino)methyl]amino}piperidine-1-carboxylate hydrochloride, 4-[(Aminoiminomethyl)amino]-1-piperidinecarboxylic acid 1,1-dimethylethyl ester monohydrochloride, 1-Boc-4-[(Aminoiminomethyl)amino]piperidine monohydrochloride, 1-Boc-4-[(Aminoiminomethyl)amino]-piperidine monohydrochloride, 4-[ AMINO]-1-PIPERIDINECARBOXYLICACID1,1-DIMETHYLETHYLESTERMONOHYDROCHLORIDE,

Complexity	297
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	2
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	278.151g/mol
Formal Charge	0
Heavy Atom Count	18
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	3
Isotope Atom Count	0
Molecular Weight	278.781g/mol
Monoisotopic Mass	278.151g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	93.9A^2
Undefined Atom Stereocenter Count	0
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