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998-39-0 molecular structure
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tributylgermane

ChemBase ID: 147974
Molecular Formular: C12H28Ge
Molecular Mass: 244.99072
Monoisotopic Mass: 246.1402779
SMILES and InChIs

SMILES:
CCCC[GeH](CCCC)CCCC
Canonical SMILES:
CCCC[GeH](CCCC)CCCC
InChI:
InChI=1S/C12H28Ge/c1-4-7-10-13(11-8-5-2)12-9-6-3/h13H,4-12H2,1-3H3
InChIKey:
KTSWILXIWHVQLR-UHFFFAOYSA-N

Cite this record

CBID:147974 http://www.chembase.cn/molecule-147974.html

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NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
tributylgermane
IUPAC Traditional name
tributylgermane
Synonyms
Tributylgermanium hydride
Tri-n-butylgermanium hydride
三正丁基氢化锗
CAS Number
998-39-0
MDL Number
MFCD00077987
PubChem SID
162242154
24865626
PubChem CID
6327830

DATA SOURCES

DATA SOURCES

All Sources Commercial Sources Non-commercial Sources
Data Source Data ID
PubChem 6327830 external link

CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
H Acceptors H Donor
LogD (pH = 5.5) 3.7027  LogD (pH = 7.4) 3.7027 
Log P 3.7027  Molar Refractivity 59.2157 cm3
Polarizability 26.929451 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)
Apperance
Liquid expand Show data source
Boiling Point
123 °C/20 mmHg(lit.) expand Show data source
123°C/20mn expand Show data source
Flash Point
113 °C expand Show data source
235.4 °F expand Show data source
Density
0.92 expand Show data source
0.949 g/mL at 25 °C(lit.) expand Show data source
Refractive Index
1.4508 expand Show data source
n20/D 1.45(lit.) expand Show data source
Storage Warning
Air & Moisture Sensitive expand Show data source
European Hazard Symbols
X expand Show data source
Harmful Harmful (Xn) expand Show data source
MSDS Link
Download expand Show data source
German water hazard class
3 expand Show data source
Risk Statements
20/21/22-41 expand Show data source
22-36/37/38 expand Show data source
Safety Statements
26-36 expand Show data source
26-36/37 expand Show data source
TSCA Listed
expand Show data source
GHS Pictograms
GHS05 expand Show data source
GHS06 expand Show data source
GHS07 expand Show data source
GHS Signal Word
Danger expand Show data source
GHS Hazard statements
H301-H315-H319-H335 expand Show data source
H302-H312-H318-H332 expand Show data source
GHS Precautionary statements
P261-P301+P310-P305+P351+P338-P302+P352-P405-P501A expand Show data source
P280-P305 + P351 + P338 expand Show data source
Personal Protective Equipment
Eyeshields, Faceshields, full-face respirator (US), Gloves, multi-purpose combination respirator cartridge (US), type ABEK (EN14387) respirator filter expand Show data source
Purity
97+% expand Show data source
99% expand Show data source
Linear Formula
[CH3(CH2)3]3GeH expand Show data source

DETAILS

DETAILS

Sigma Aldrich Sigma Aldrich
Sigma Aldrich - 409170 external link
General description
Atomic number of base material: 32 Germanium
Packaging
1 g in glass bottle
Application
Efficient reducing agent for benzylic chlorides.1

REFERENCES

REFERENCES

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PATENTS

PATENTS

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INTERNET

INTERNET

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