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3244-41-5 molecular structure
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potassium tetraphenylboranuide

ChemBase ID: 129085
Molecular Formular: C24H20BK
Molecular Mass: 358.3249
Monoisotopic Mass: 358.12951272
SMILES and InChIs

SMILES:
[K+].c1c(cccc1)[B-](c1ccccc1)(c1ccccc1)c1ccccc1
Canonical SMILES:
c1ccc(cc1)[B-](c1ccccc1)(c1ccccc1)c1ccccc1.[K+]
InChI:
InChI=1S/C24H20B.K/c1-5-13-21(14-6-1)25(22-15-7-2-8-16-22,23-17-9-3-10-18-23)24-19-11-4-12-20-24;/h1-20H;/q-1;+1
InChIKey:
MAMCUZQNCMYPCY-UHFFFAOYSA-N

Cite this record

CBID:129085 http://www.chembase.cn/molecule-129085.html

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NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
potassium tetraphenylboranuide
IUPAC Traditional name
potassium tetraphenylborate
Synonyms
Potassium tetrakis(phenyl)borate
Potassium tetraphenylboride
Potassium tetraphenylborate
Potassium tetraphenylborate
四苯基硼酸钾
CAS Number
3244-41-5
MDL Number
MFCD03093877
PubChem SID
24870357
162223384
PubChem CID
6432333
23665558
Chemspider ID
4937589
Wikipedia Title
Potassium_tetraphenylborate

DATA SOURCES

DATA SOURCES

All Sources Commercial Sources Non-commercial Sources
Data Source Data ID Price
Sigma Aldrich
466689 external link Add to cart Please log in.

CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
H Acceptors H Donor
LogD (pH = 5.5) 5.9088  LogD (pH = 7.4) 5.9088 
Log P 5.9088  Molar Refractivity 101.8972 cm3
Polarizability 41.872147 Å3 Polar Surface Area 0.0 Å2
Rotatable Bonds Lipinski's Rule of Five false 

PROPERTIES

PROPERTIES

Physical Property Safety Information Product Information Bioassay(PubChem)
Melting Point
>300 °C(lit.) expand Show data source
European Hazard Symbols
Irritant Irritant (Xi) expand Show data source
MSDS Link
Download expand Show data source
German water hazard class
3 expand Show data source
Risk Statements
36/37/38 expand Show data source
Safety Statements
26-36 expand Show data source
GHS Pictograms
GHS07 expand Show data source
GHS Signal Word
Warning expand Show data source
GHS Hazard statements
H315-H319-H335 expand Show data source
GHS Precautionary statements
P261-P305 + P351 + P338 expand Show data source
Personal Protective Equipment
dust mask type N95 (US), Eyeshields, Gloves expand Show data source
Purity
97% expand Show data source
Linear Formula
(C6H5)4BK expand Show data source

DETAILS

DETAILS

Wikipedia Wikipedia Sigma Aldrich Sigma Aldrich
Sigma Aldrich - 466689 external link
Packaging
1, 5 g in glass bottle

REFERENCES

REFERENCES

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PATENTS

PATENTS

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INTERNET

INTERNET

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