AG003AGY

530116-33-7 | 4-(2-aminopropan-2-yl)-1-Boc-piperidine

AG003AGY

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CAS Number	530116-33-7
Catalog Number	AG003AGY(AGN-PC-0WAKE2)
Chemical Name	4-(2-aminopropan-2-yl)-1-Boc-piperidine
IUPAC Name	tert-butyl 4-(2-aminopropan-2-yl)piperidine-1-carboxylate
InChI	InChI=1S/C13H26N2O2/c1-12(2,3)17-11(16)15-8-6-10(7-9-15)13(4,5)14/h10H,6-9,14H2,1-5H3
InChI Key	FXUHDTBFKFLRFO-UHFFFAOYSA-N
MDL Number	MFCD22034255
Molecular Formula	C13H26N2O2
Molecular Weight	242.3577
SMILES	CC(C)(C)OC(=O)N1CCC(CC1)C(C)(C)N
Synonyms	4-(2-aminopropan-2-yl)-1-Boc-piperidine, 530116-33-7, tert-butyl 4-(2-aminopropan-2-yl)piperidine-1-carboxylate, SCHEMBL6402693, KS-000004QS, MFCD22034255, ZINC96987003, SB13020, AK340517, AS-52592, CS-0051207,

Complexity	274
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	242.199g/mol
Formal Charge	0
Heavy Atom Count	17
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	242.363g/mol
Monoisotopic Mass	242.199g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	55.6A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.5

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302
Packing Group
Precautionary statements	P280-P305+P351+P338
UN Code

Certificate of Analysis

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