N-Cbz-3-hydroxypiperidine - CAS 95798-22-4

Catalog:	BB041848
Product Name:	N-Cbz-3-hydroxypiperidine
CAS:	95798-22-4
Synonyms:	3-hydroxy-1-piperidinecarboxylic acid (phenylmethyl) ester; benzyl 3-hydroxypiperidine-1-carboxylate

Technical Data

Safety and Hazards

Patents

Computed Properties

IUPAC Name:	benzyl 3-hydroxypiperidine-1-carboxylate
Description:	N-Cbz-3-hydroxypiperidine (CAS# 95798-22-4) is a useful research chemical.
Molecular Weight:	235.28
Molecular Formula:	C13H17NO3
Canonical SMILES:	C1CC(CN(C1)C(=O)OCC2=CC=CC=C2)O
InChI:	InChI=1S/C13H17NO3/c15-12-7-4-8-14(9-12)13(16)17-10-11-5-2-1-3-6-11/h1-3,5-6,12,15H,4,7-10H2
InChI Key:	NDGWBAFATMSBHZ-UHFFFAOYSA-N
Boiling Point:	384.9 °C at 760 mmHg
Density:	1.22 g/cm³
LogP:	1.71780

Publication Number	Title	Priority Date
CN-111918651-A	GCN2 inhibitors and uses thereof	20180129
US-10253040-B1	MK2 inhibitors and uses thereof	20140917
US-10577380-B2	MK2 inhibitors and uses thereof	20140917
US-2021053984-A1	Mk2 inhibitors and uses thereof	20140917
US-2016347737-A1	Protein kinase c inhibitors and methods of their use	20140806

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GHS Hazard Statement:	H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]; H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]; H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]
Precautionary Statement:	P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501
Signal Word:	Warning

Complexity:	251
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	235.1208434
Formal Charge:	0
Heavy Atom Count:	17
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	235.1208434
Rotatable Bond Count:	3
Topological Polar Surface Area:	49.8
Undefined Atom Stereocenter Count:	1
Undefined Bond Stereocenter Count:	0
XLogP3:	1.5