N-Boc-piperidine - CAS 75844-69-8

Catalog:	BB035416
Product Name:	N-Boc-piperidine
CAS:	75844-69-8
Synonyms:	tert-butyl piperidine-1-carboxylate

Technical Data

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Computed Properties

IUPAC Name:	tert-butyl piperidine-1-carboxylate
Description:	N-Boc-piperidine (CAS# 75844-69-8) is a useful research chemical for organic synthesis and other chemical processes.
Molecular Weight:	185.26
Molecular Formula:	C10H19NO2
Canonical SMILES:	CC(C)(C)OC(=O)N1CCCCC1
InChI:	InChI=1S/C10H19NO2/c1-10(2,3)13-9(12)11-7-5-4-6-8-11/h4-8H2,1-3H3
InChI Key:	RQCNHUCCQJMSRG-UHFFFAOYSA-N
Boiling Point:	130-140 °C / 15 mmHg
Purity:	97.0 %
Density:	0.964 g/cm³
Appearance:	Colorless to yellowish liquid
MDL:	MFCD02093935
LogP:	2.34530

Publication Number	Title	Priority Date
CN-113480534-A	Benzimidazole or azabenzimidazole-6-carboxylic acid compounds and application thereof	20210723
CN-113292561-A	Compound with dipyrrolopyridine structure, preparation method and medical application	20210522
CN-113372868-A	Ultraviolet activated double-component super-hydrophobic polyurethane ring winding adhesive	20210520
CN-113248481-A	EZH2 covalent irreversible inhibitor, preparation method and application thereof	20210419
CN-113024565-A	Radioactive isotope carbon-14 labeled ibrutinib and synthesis method thereof	20210331

PMID	Publication Date	Title	Journal
22967289	20121010	Dynamics of catalytic resolution of 2-lithio-N-Boc-piperidine by ligand exchange	Journal of the American Chemical Society
20469892	20100618	Regioselective and stereoselective copper(I)-promoted allylation and conjugate addition of N-Boc-2-lithiopyrrolidine and N-Boc-2-lithiopiperidine	The Journal of organic chemistry
20462193	20100602	Asymmetric deprotonation of N-boc piperidine: react IR monitoring and mechanistic aspects	Journal of the American Chemical Society
20175161	20100406	Asymmetric substitutions of 2-lithiated N-boc-piperidine and N-Boc-azepine by dynamic resolution	Chemistry (Weinheim an der Bergstrasse, Germany)
18683935	20080904	Synthesis of 2-arylpiperidines by palladium couplings of aryl bromides with organozinc species derived from deprotonation of N-boc-piperidine	Organic letters

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GHS Hazard Statement:	H301 (92.68%): Toxic if swallowed [Danger Acute toxicity, oral]
Precautionary Statement:	P261, P264, P270, P271, P273, P280, P301+P310, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P391, P403+P233, P405, and P501
Signal Word:	Danger

Complexity:	178
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	185.141578849
Formal Charge:	0
Heavy Atom Count:	13
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	185.141578849
Rotatable Bond Count:	2
Topological Polar Surface Area:	29.5 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	2