1,8-Bis(tetramethylguanidino)naphthalene - CAS 442873-72-5

Name: 1,8-Bis(tetramethylguanidino)naphthalene
Brand: BOC Sciences
Rating: 5 (1 reviews)

Catalog:	BB025558
Product Name:	1,8-Bis(tetramethylguanidino)naphthalene
CAS:	442873-72-5
Synonyms:	1,1,2,3-tetramethyl-3-[8-[methyl-(N,N,N'-trimethylcarbamimidoyl)amino]naphthalen-1-yl]guanidine

Technical Data

IUPAC Name:	1,1,2,3-tetramethyl-3-[8-[methyl-(N,N,N'-trimethylcarbamimidoyl)amino]naphthalen-1-yl]guanidine
Description:	1,8-Bis(tetramethylguanidino)naphthalene (CAS# 442873-72-5 ) is a useful research chemical.
Molecular Weight:	354.49
Molecular Formula:	C20H30N6
Canonical SMILES:	CN=C(N(C)C)N(C)C1=CC=CC2=C1C(=CC=C2)N(C)C(=NC)N(C)C
InChI:	InChI=1S/C20H30N6/c1-21-19(23(3)4)25(7)16-13-9-11-15-12-10-14-17(18(15)16)26(8)20(22-2)24(5)6/h9-14H,1-8H3
InChI Key:	TXYQMVROVVJZHJ-UHFFFAOYSA-N
Boiling Point:	472.5 °C at 760 mmHg
Density:	1.03 g/cm³
MDL:	MFCD06798180
LogP:	2.80700

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PMID	Publication Date	Title	Journal
22996608	20121029	Wrapping an organic reducing reagent in a cationic boron complex and its use in the synthesis of polyhalide monoanionic networks	Chemistry (Weinheim an der Bergstrasse, Germany)
22434010	20120507	Proton sponge-functionalized silica as high performance adsorbents for solid-phase extraction of trace perfluoroalkyl sulfonates in the environmental water samples and their direct analysis by MALDI-TOF-MS	The Analyst
21645709	20110715	Quantitative detection of trace perfluorinated compounds in environmental water samples by Matrix-assisted Laser Desorption/Ionization-Time of Flight Mass Spectrometry with 1,8-bis(tetramethylguanidino)-naphthalene as matrix	Talanta
22125449	20110101	Emission inventory for PFOS in China: review of past methodologies and suggestions	TheScientificWorldJournal
14604346	20031114	1,8-bis(dimethylethyleneguanidino)naphthalene: tailoring the basicity of bisguanidine 'proton sponges' by experiment and theory	The Journal of organic chemistry

Complexity:	468
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	354.25319498
Formal Charge:	0
Heavy Atom Count:	26
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	354.25319498
Rotatable Bond Count:	6
Topological Polar Surface Area:	37.7
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	2.3