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64-20-0 molecular structure
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tetramethylazanium bromide

ChemBase ID: 111357
Molecular Formular: C4H12BrN
Molecular Mass: 154.04878
Monoisotopic Mass: 153.01531139
SMILES and InChIs

SMILES:
[Br-].C[N+](C)(C)C
Canonical SMILES:
C[N+](C)(C)C.[Br-]
InChI:
InChI=1S/C4H12N.BrH/c1-5(2,3)4;/h1-4H3;1H/q+1;/p-1
InChIKey:
DDFYFBUWEBINLX-UHFFFAOYSA-M

Cite this record

CBID:111357 http://www.chembase.cn/molecule-111357.html

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NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
tetramethylazanium bromide
IUPAC Traditional name
tetramethylammonium bromide
tetramethylammonium ion bromide
Synonyms
Tetramethylammonium bromide
TETRAMETHYLAMMONIUM BROMIDE
四甲基溴化铵
CAS Number
64-20-0
EC Number
200-581-2
MDL Number
MFCD00011626
Beilstein Number
3620955
PubChem SID
24851710
24866694
162096606
24888935
24888934
PubChem CID
66137

CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
H Acceptors H Donor
LogD (pH = 5.5) -3.9721673  LogD (pH = 7.4) -3.9721673 
Log P -3.9721673  Molar Refractivity 35.9017 cm3
Polarizability 9.572162 Å3 Polar Surface Area 0.0 Å2
Rotatable Bonds Lipinski's Rule of Five true 

PROPERTIES

PROPERTIES

Physical Property Safety Information Product Information Bioassay(PubChem)
Solubility
H2O: soluble0.1 g/mL, clear, colorless expand Show data source
Melting Point
>300 °C(lit.) expand Show data source
Absorption Wavelength
λ: 240 nm Amax: 0.06 expand Show data source
λ: 250 nm Amax: 0.03 expand Show data source
λ: 260 nm Amax: 0.02 expand Show data source
λ: 500 nm Amax: 0.02 expand Show data source
RTECS
BS7600000 expand Show data source
European Hazard Symbols
Toxic Toxic (T) expand Show data source
Harmful Harmful (Xn) expand Show data source
UN Number
2811 expand Show data source
MSDS Link
Download expand Show data source
Download expand Show data source
Download expand Show data source
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
6.1 expand Show data source
Packing Group
2 expand Show data source
Risk Statements
25-36/37/38 expand Show data source
R:22 expand Show data source
Safety Statements
26-28-36-45 expand Show data source
S:36/37/39 expand Show data source
GHS Pictograms
GHS06 expand Show data source
GHS Signal Word
Danger expand Show data source
GHS Hazard statements
H300-H315-H319-H335 expand Show data source
GHS Precautionary statements
P261-P264-P301 + P310-P305 + P351 + P338 expand Show data source
Personal Protective Equipment
Eyeshields, Faceshields, Gloves, type P2 (EN 143) respirator cartridges expand Show data source
RID/ADR
UN 2811 6.1/PG 2 expand Show data source
Purity
≥97.0% (AT) expand Show data source
≥98.0% expand Show data source
≥99.0% expand Show data source
≥99.0% (AT) expand Show data source
98% expand Show data source
Grade
ACS reagent expand Show data source
for electrochemical analysis expand Show data source
for ion pair chromatography expand Show data source
purum expand Show data source
Certificate of Analysis
Download expand Show data source
Suitability
corresponds to standard for filter test expand Show data source
Impurities
≤0.5% trimethylamine expand Show data source
≤0.5% trimethylamine hydrobromide expand Show data source
λ
10 % in H2O expand Show data source
Linear Formula
(CH3)4N(Br) expand Show data source

DETAILS

DETAILS

MP Biomedicals MP Biomedicals Sigma Aldrich Sigma Aldrich
MP Biomedicals - 05218819 external link
MP Biomedicals Rare Chemical collection
Sigma Aldrich - 87709 external link
General description
Visit our Sensor Applications portal to learn more.
Sigma Aldrich - 426296 external link
Packaging
25, 100 g in poly bottle
Sigma Aldrich - 195758 external link
Packaging
100, 500 g in poly bottle

REFERENCES

REFERENCES

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PATENTS

PATENTS

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INTERNET

INTERNET

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