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1-[3-(4-Methylpiperazin-1-yl)phenyl]methanamine

1-[3-(4-Methylpiperazin-1-yl)phenyl]methanamine - CAS 672325-37-0

Catalog:	BB033223
Product Name:	1-[3-(4-Methylpiperazin-1-yl)phenyl]methanamine
CAS:	672325-37-0
Synonyms:	[3-(4-methyl-1-piperazinyl)phenyl]methanamine; [3-(4-methylpiperazin-1-yl)phenyl]methanamine

Technical Data

Patents

Computed Properties

IUPAC Name:	[3-(4-methylpiperazin-1-yl)phenyl]methanamine
Description:	1-[3-(4-Methylpiperazin-1-yl)phenyl]methanamine (CAS# 672325-37-0) is a useful research chemical.
Molecular Weight:	205.30
Molecular Formula:	C12H19N3
Canonical SMILES:	CN1CCN(CC1)C2=CC=CC(=C2)CN
InChI:	InChI=1S/C12H19N3/c1-14-5-7-15(8-6-14)12-4-2-3-11(9-12)10-13/h2-4,9H,5-8,10,13H2,1H3
InChI Key:	VKTLTRIKVYJVOX-UHFFFAOYSA-N
Boiling Point:	351.2 °C at 760 mmHg
Density:	1.065 g/cm³
MDL:	MFCD07368540
LogP:	1.60030

Publication Number	Title	Priority Date
US-2013316981-A1	Tertiary amines, medicaments containing said amines, use thereof and processes for the preparation thereof	20120525
US-9078909-B2	Tertiary amines, medicaments containing said amines, use thereof and processes for the preparation thereof	20120525
AU-2013226013-A1	Inhibitors of Hepatitis B Virus Covalently Closed Circular DNA Formation and Their Method of Use	20120229
AU-2013226013-B2	Inhibitors of Hepatitis B Virus Covalently Closed Circular DNA Formation and Their Method of Use	20120229
AU-2016253583-A1	Inhibitors of hepatitis b virus covalently closed circular dna formation and their method of use	20120229

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Related Functional Groups

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Complexity:	187
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	205.157897619
Formal Charge:	0
Heavy Atom Count:	15
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	205.157897619
Rotatable Bond Count:	2
Topological Polar Surface Area:	32.5
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	0.7