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6063-55-4 molecular structure
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tris(2H3)methylborane

ChemBase ID: 138103
Molecular Formular: C3H9B
Molecular Mass: 55.91456
Monoisotopic Mass: 56.07973069
SMILES and InChIs

SMILES:
CB(C)C
Canonical SMILES:
CB(C)C
InChI:
InChI=1S/C3H9B/c1-4(2)3/h1-3H3
InChIKey:
WXRGABKACDFXMG-UHFFFAOYSA-N

Cite this record

CBID:138103 http://www.chembase.cn/molecule-138103.html

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NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
tris(2H3)methylborane
IUPAC Traditional name
tris(2H3)methylborane
Synonyms
Trimethylboron-d9
三甲基硼-d9
CAS Number
6063-55-4
MDL Number
MFCD00145460
PubChem SID
162232361
24870063
PubChem CID
16213066

DATA SOURCES

DATA SOURCES

All Sources Commercial Sources Non-commercial Sources
Data Source Data ID Price
Sigma Aldrich
463426 external link Add to cart Please log in.
Data Source Data ID
PubChem 16213066 external link

CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
H Acceptors H Donor
LogD (pH = 5.5) 1.829  LogD (pH = 7.4) 1.829 
Log P 1.829  Molar Refractivity 16.6473 cm3
Polarizability 8.338507 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)
Melting Point
-161.5 °C(lit.) expand Show data source
Boiling Point
-20.2 °C(lit.) expand Show data source
Vapor Density
2.3 (vs air) expand Show data source
Mass Shift
M+9 expand Show data source
European Hazard Symbols
Corrosive Corrosive (C) expand Show data source
Flammable Flammable (F) expand Show data source
UN Number
3160 expand Show data source
MSDS Link
Download expand Show data source
German water hazard class
1 expand Show data source
Hazard Class
2.3 expand Show data source
Risk Statements
17-34 expand Show data source
Safety Statements
7-23-26-36/37/39-43.11-45 expand Show data source
RID/ADR
UN 3160 2.3 expand Show data source
Purity
99.4% (CP) expand Show data source
Grade
electronic grade expand Show data source
Isotopic Purity
99 atom % D expand Show data source
Linear Formula
B(CD3)3 expand Show data source

DETAILS

DETAILS

Sigma Aldrich Sigma Aldrich
Sigma Aldrich - 463426 external link
Application
The deposition of trimethylboron-d9 derived boron-carbon films can result in increased device performance.
Packaging
5 g in ss cylinder
Recommended products
Stainless steel regulators Z527416 or Z527424 are recommended.

REFERENCES

REFERENCES

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PATENTS

PATENTS

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INTERNET

INTERNET

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