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1-Methyl-4-(hydroxymethyl)-1,2,3,6-tetrahydropyridine

1-Methyl-4-(hydroxymethyl)-1,2,3,6-tetrahydropyridine - CAS 36166-75-3

Catalog:	BB022890
Product Name:	1-Methyl-4-(hydroxymethyl)-1,2,3,6-tetrahydropyridine
CAS:	36166-75-3
Synonyms:	(1-methyl-3,6-dihydro-2H-pyridin-4-yl)methanol; (1-methyl-3,6-dihydro-2H-pyridin-4-yl)methanol

Technical Data

Patents

Computed Properties

IUPAC Name:	(1-methyl-3,6-dihydro-2H-pyridin-4-yl)methanol
Description:	1-Methyl-4-(hydroxymethyl)-1,2,3,6-tetrahydropyridine (CAS# 36166-75-3) is a useful research chemical.
Molecular Weight:	127.18
Molecular Formula:	C7H13NO
Canonical SMILES:	CN1CCC(=CC1)CO
InChI:	InChI=1S/C7H13NO/c1-8-4-2-7(6-9)3-5-8/h2,9H,3-6H2,1H3
InChI Key:	XCZCVUOQSMDKQW-UHFFFAOYSA-N
Boiling Point:	214 °C at 760 mmHg
Density:	0.998 g/cm³
LogP:	0.17850

Publication Number	Title	Priority Date
WO-2020183011-A1	Htr1d inhibitors and uses thereof in the treatment of cancer	20190314
US-2008015179-A1	Modulators of muscarinic receptors	20051222
US-7858635-B2	Spiro compounds as modulators of muscarinic receptors	20051222
US-2011092529-A1	1,2,4-Triazole Derivatives and Their Use as Oxytocin Antagonists	20050304
US-2006079505-A1	Modulators of muscarinic receptors	20040819

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Complexity:	120
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	127.099714038
Formal Charge:	0
Heavy Atom Count:	9
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	127.099714038
Rotatable Bond Count:	1
Topological Polar Surface Area:	23.5
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	-0.4