Tetrapropylammonium Bisulfate - CAS 56211-70-2

Catalog:	BB029295
Product Name:	Tetrapropylammonium Bisulfate
CAS:	56211-70-2
Synonyms:	hydrogen sulfate;tetrapropylammonium; hydrogen sulfate;tetrapropylazanium

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Computed Properties

IUPAC Name:	hydrogen sulfate;tetrapropylazanium
Description:	Tetrapropylammonium Bisulfate (CAS# 56211-70-2) is used in the preparation of a room temperature ionic liquid.
Molecular Weight:	283.43
Molecular Formula:	C12H29NO4S
Canonical SMILES:	CCC[N+](CCC)(CCC)CCC.OS(=O)(=O)[O-]
InChI:	InChI=1S/C12H28N.H2O4S/c1-5-9-13(10-6-2,11-7-3)12-8-4;1-5(2,3)4/h5-12H2,1-4H3;(H2,1,2,3,4)/q+1;/p-1
InChI Key:	MOXJKKOSZCHGEU-UHFFFAOYSA-M
Appearance:	White powder
LogP:	3.52860

Publication Number	Title	Priority Date
CN-113121935-A	Sheet for touch panel	20191227
JP-2021108107-A	Touch panel sheet	20191227
CN-113004244-A	Trelagliptin impurity and preparation method and application thereof	20191219
JP-2021019111-A	Chemical mechanical polishing composition, its manufacturing method, and polishing method	20190722
WO-2020170185-A1	Substantially pure lanreotide or its salt & process thereof	20190221

PMID	Publication Date	Title	Journal
22733511	20120601	Development and validation of a reversed-phase liquid chromatographic method for analysis of demeclocycline and related impurities	Journal of separation science

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Related Functional Groups

Nitrogen Compounds

[1427004-19-0]
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[102388-00-1]
1-(Chloromethyl)-3-nitro-1H-pyrazole
[1281984-38-0]
1-Cyclopentyl-3,5-dinitro-1H-pyrazole
[1170836-25-5]
1-Cyclopentyl-5-nitro-1H-pyrazole
[1243387-55-4]
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GHS Hazard Statement:	H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
Precautionary Statement:	P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501
Signal Word:	Warning

Complexity:	156
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	2
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	283.18172958
Formal Charge:	0
Heavy Atom Count:	18
Hydrogen Bond Acceptor Count:	4
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	283.18172958
Rotatable Bond Count:	8
Topological Polar Surface Area:	85.8 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0