1-Benzyl-3-methylpiperidin-3-ol - CAS 6560-72-1

Catalog:	BB032774
Product Name:	1-Benzyl-3-methylpiperidin-3-ol
CAS:	6560-72-1
Synonyms:	3-methyl-1-(phenylmethyl)-3-piperidinol; 1-benzyl-3-methylpiperidin-3-ol

Technical Data

Patents

Computed Properties

IUPAC Name:	1-benzyl-3-methylpiperidin-3-ol
Description:	1-Benzyl-3-methylpiperidin-3-ol (CAS# 6560-72-1) is a useful research chemical.
Molecular Weight:	205.30
Molecular Formula:	C13H19NO
Canonical SMILES:	CC1(CCCN(C1)CC2=CC=CC=C2)O
InChI:	InChI=1S/C13H19NO/c1-13(15)8-5-9-14(11-13)10-12-6-3-2-4-7-12/h2-4,6-7,15H,5,8-11H2,1H3
InChI Key:	XOOUIRSDEYKUGM-UHFFFAOYSA-N
Boiling Point:	300.2 °C at 760 mmHg
Density:	1.073 g/cm³
LogP:	1.97130

Publication Number	Title	Priority Date
EP-2132177-A1	Pim kinase inhibitors and methods of their use	20070301
WO-2008106692-A1	Pim kinase inhibitors and methods of their use	20070301
EP-1697354-B1	Isothiazole dioxides as cxc- and cc- chemokine receptor ligands	20031222
US-2006025453-A1	Isothiazole dioxides as CXC- and CC-chemokine receptor ligands	20031222
US-7671212-B2	Isothiazole dioxides as CXC- and CC-chemokine receptor ligands	20031222

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Complexity:	201
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	205.14666423
Formal Charge:	0
Heavy Atom Count:	15
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	205.14666423
Rotatable Bond Count:	2
Topological Polar Surface Area:	23.5
Undefined Atom Stereocenter Count:	1
Undefined Bond Stereocenter Count:	0
XLogP3:	1.8