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1067-42-1

Basic Information
CAS No.: 1067-42-1
Name: TETRA-N-BUTYLGERMANE
Article Data: 17
Molecular Structure:
Molecular Structure of 1067-42-1 (TETRA-N-BUTYLGERMANE)
Formula: C16H36Ge
Molecular Weight: 301.052
Synonyms: NSC 65798;Tetra-n-butylgermane;Tetrabutylgermane;Tetrabutylgermanium;
EINECS: 213-929-3
Density: 0.93 g/mL at 25 °C(lit.)
Melting Point: -74.1°C
Boiling Point: >100 °C(lit.)
Flash Point: >230 °F
Appearance: colorless to light yellow liquid
Hazard Symbols: HarmfulXn
Risk Codes: 20/21/22
Safety: 36
PSA: 0.00000
LogP: 6.63560
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Specification

The CAS register number of Tetrabutylgermanium is 1067-42-1. It also can be called as Germane, tetrabutyl- and the IUPAC name about this chemical is tetrabutylgermane. The molecular formula about this chemical is C16H36Ge and the molecular weight is 301.10. It belongs to the following product categories, such as Classes of Metal Compounds; Ge (Germanium) Compounds; Semimetal Compounds and so on. This chemical is harmful by inhalation, in contact with skin and if swallowed. When you are using it, wear suitable protective clothing.

Physical properties about Tetrabutylgermanium are: (1)Rotatable Bond Count: 12; (2)Exact Mass: 302.202879; (3)MonoIsotopic Mass: 302.202879; (4)Heavy Atom Count: 17; (5)Complexity: 116; (6)Covalently-Bonded Unit Count: 1.

Uses of Tetrabutylgermanium: it can be used to produce 4-butyl-benzonitrile with terephthalonitrile. This reaction will need reagent acetonitrile. The yield is about 50%.

You can still convert the following datas into molecular structure:
(1)SMILES: CCCC[Ge+](CCCC)(CCCC)CCCC
(2)InChI: InChI=1/C16H36Ge/c1-5-9-13-17(14-10-6-2,15-11-7-3)16-12-8-4/h5-16H2,1-4H3/q+1
(3)InChIKey: BMHPMXJZSYJGSG-UHFFFAOYAM
(4)Std. InChI: InChI=1S/C16H36Ge/c1-5-9-13-17(14-10-6-2,15-11-7-3)16-12-8-4/h5-16H2,1-4H3/q+1
(5)Std. InChIKey: BMHPMXJZSYJGSG-UHFFFAOYSA-N