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1923-70-2 molecular structure
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tetrabutylazanium perchlorate

ChemBase ID: 112747
Molecular Formular: C16H36ClNO4
Molecular Mass: 341.91434
Monoisotopic Mass: 341.23328632
SMILES and InChIs

SMILES:
[O-][Cl](=O)(=O)=O.CCCC[N+](CCCC)(CCCC)CCCC
Canonical SMILES:
[O-][Cl](=O)(=O)=O.CCCC[N+](CCCC)(CCCC)CCCC
InChI:
InChI=1S/C16H36N.ClHO4/c1-5-9-13-17(14-10-6-2,15-11-7-3)16-12-8-4;2-1(3,4)5/h5-16H2,1-4H3;(H,2,3,4,5)/q+1;/p-1
InChIKey:
KBLZDCFTQSIIOH-UHFFFAOYSA-M

Cite this record

CBID:112747 http://www.chembase.cn/molecule-112747.html

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NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
tetrabutylazanium perchlorate
IUPAC Traditional name
tetrabutylammonium ion perchlorate ion
tetrabutylammonium perchlorate
Synonyms
TETRA-n-BUTYL AMMONIUM PERCHLORATE
Tetrabutylammonium perchlorate
Tetra-n-butylammonium perchlorate
Tetra-n-butylammonium perchlorate, electrochemical grade
四丁基高氯酸铵
四正丁基高氯酸铵
四正丁基高氯酸铵, 电子级
CAS Number
1923-70-2
EC Number
217-655-5
MDL Number
MFCD00038722
Beilstein Number
3579274
PubChem SID
24888804
24900443
24888811
162097566
PubChem CID
74723

CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
H Acceptors H Donor
LogD (pH = 5.5) 1.3234289  LogD (pH = 7.4) 1.3234289 
Log P 1.3234289  Molar Refractivity 91.3961 cm3
Polarizability 31.734425 Å3 Polar Surface Area 0.0 Å2
Rotatable Bonds 12  Lipinski's Rule of Five true 

PROPERTIES

PROPERTIES

Physical Property Safety Information Product Information Bioassay(PubChem)
Solubility
acetonitrile: soluble0.1 g/mL, clear, colorless expand Show data source
Soluble in ethanol. Very slightly soluble in water expand Show data source
Apperance
Crystalline expand Show data source
Melting Point
210-212°C expand Show data source
210-217°C expand Show data source
211-215 °C expand Show data source
Storage Warning
Hygroscopic expand Show data source
European Hazard Symbols
Oxidising Oxidising (O) expand Show data source
Irritant Irritant (Xi) expand Show data source
UN Number
1479 expand Show data source
UN1481 expand Show data source
MSDS Link
Download expand Show data source
Download expand Show data source
Download expand Show data source
German water hazard class
3 expand Show data source
Hazard Class
5.1 expand Show data source
Packing Group
2 expand Show data source
II expand Show data source
Risk Statements
5-8-36/37/38 expand Show data source
R:36/37/38 expand Show data source
Safety Statements
17-26-36 expand Show data source
17-26-37-60 expand Show data source
S:20-25-26-37/39 expand Show data source
TSCA Listed
expand Show data source
GHS Pictograms
GHS03 expand Show data source
GHS07 expand Show data source
GHS Signal Word
Danger expand Show data source
GHS Hazard statements
H272-H315-H319-H335 expand Show data source
GHS Precautionary statements
P220-P261-P305 + P351 + P338 expand Show data source
P221-P210-P305+P351+P338-P302+P352-P405-P501A expand Show data source
Personal Protective Equipment
Eyeshields, full-face particle respirator type N100 (US), Gloves, respirator cartridge type N100 (US), type P1 (EN143) respirator filter, type P3 (EN 143) respirator cartridges expand Show data source
RID/ADR
UN 1479 5.1/PG 2 expand Show data source
Purity
≥98.0% (T) expand Show data source
≥99.0% expand Show data source
≥99.0% (T) expand Show data source
99+% expand Show data source
Grade
for electrochemical analysis expand Show data source
Certificate of Analysis
Download expand Show data source
Linear Formula
(CH3CH2CH2CH2)4N(ClO4) expand Show data source

DETAILS

DETAILS

MP Biomedicals MP Biomedicals Sigma Aldrich Sigma Aldrich
MP Biomedicals - 05225628 external link
MP Biomedicals Rare Chemical collection
Sigma Aldrich - 86885 external link
Packaging
25, 100 g in poly bottle
Sigma Aldrich - 86893 external link
Application
Supporting electrolyte
General description
Visit our Sensor Applications portal to learn more.

REFERENCES

REFERENCES

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PATENTS

PATENTS

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INTERNET

INTERNET

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