1-Boc-4-hydroxy-4-methylpiperidine - CAS 406235-30-1

Catalog:	BB024594
Product Name:	1-Boc-4-hydroxy-4-methylpiperidine
CAS:	406235-30-1
Synonyms:	4-hydroxy-4-methyl-1-piperidinecarboxylic acid tert-butyl ester; tert-butyl 4-hydroxy-4-methylpiperidine-1-carboxylate

Technical Data

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Computed Properties

IUPAC Name:	tert-butyl 4-hydroxy-4-methylpiperidine-1-carboxylate
Description:	1-Boc-4-hydroxy-4-methylpiperidine (CAS# 406235-30-1) is a useful research chemical.
Molecular Weight:	215.29
Molecular Formula:	C11H21NO3
Canonical SMILES:	CC1(CCN(CC1)C(=O)OC(C)(C)C)O
InChI:	InChI=1S/C11H21NO3/c1-10(2,3)15-9(13)12-7-5-11(4,14)6-8-12/h14H,5-8H2,1-4H3
InChI Key:	SWUCHJAQBNXPBO-UHFFFAOYSA-N
Boiling Point:	296.362 °C at 760 mmHg
Density:	1.076 g/cm³
LogP:	1.70620

Publication Number	Title	Priority Date
WO-2021105115-A1	Substituted aminoquinolones as dgkalpha inhibitors for immune activation	20191128
WO-2021071802-A1	Aryl heterocyclic compounds as kv1.3 potassium shaker channel blockers	20191007
CN-111658653-A	Use of phosphodiesterase inhibitors	20190308
WO-2020182076-A1	Uses of phosphodiesterase inhibitors	20190308
TW-202100151-A	Use of phosphodiesterase inhibitor	20190308

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GHS Hazard Statement:	H302 (50%): Harmful if swallowed [Warning Acute toxicity, oral]
Precautionary Statement:	P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501
Signal Word:	Warning

Complexity:	237
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	215.15214353
Formal Charge:	0
Heavy Atom Count:	15
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	215.15214353
Rotatable Bond Count:	2
Topological Polar Surface Area:	49.8 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	1.2