4-(4-Methylpiperazino)benzyl Alcohol - CAS 342405-34-9

Catalog:	BB022023
Product Name:	4-(4-Methylpiperazino)benzyl Alcohol
CAS:	342405-34-9
Synonyms:	[4-(4-methyl-1-piperazinyl)phenyl]methanol; [4-(4-methylpiperazin-1-yl)phenyl]methanol

Technical Data

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Computed Properties

IUPAC Name:	[4-(4-methylpiperazin-1-yl)phenyl]methanol
Description:	4-(4-Methylpiperazino)benzyl Alcohol (CAS# 342405-34-9) is a useful research chemical.
Molecular Weight:	206.28
Molecular Formula:	C12H18N2O
Canonical SMILES:	CN1CCN(CC1)C2=CC=C(C=C2)CO
InChI:	InChI=1S/C12H18N2O/c1-13-6-8-14(9-7-13)12-4-2-11(10-15)3-5-12/h2-5,15H,6-10H2,1H3
InChI Key:	ZCAGHLIBKHFJDU-UHFFFAOYSA-N
Boiling Point:	363.7 °C at 760 mmHg
Density:	1.105 g/cm³
MDL:	MFCD02682064
LogP:	0.93360

Publication Number	Title	Priority Date
AU-2017283790-B2	Substituted pyridines as inhibitors of DNMT1	20160613
CN-109563043-A	The substituted pyridine of inhibitor as DNMT1	20160613
EP-3468953-A1	Substituted pyridines as inhibitors of dnmt1	20160613
JP-2019517596-A	Substituted pyridines as inhibitors of DNMT1	20160613
US-2019194166-A1	Substituted pyridines as inhibitors of dnmt1	20160613

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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:	182
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	206.141913202
Formal Charge:	0
Heavy Atom Count:	15
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	206.141913202
Rotatable Bond Count:	2
Topological Polar Surface Area:	26.7
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	1