Trihexylsilane

CAS: 2929-52-4 · C18H40Si

2D Structure

Loading 3D structure...

CAS Registry Number

2929-52-4

SMILES

CCCCCC[SiH](CCCCCC)CCCCCC

InChI Key

IBNSYFQZHBBNLR-UHFFFAOYSA-N

InChI

InChI=1S/C18H40Si/c1-4-7-10-13-16-19(17-14-11-8-5-2)18-15-12-9-6-3/h19H,4-18H2,1-3H3

Comprehensive physical and chemical properties

Property	Value	Source
Molecular Mass	284.60 g/mol	CAS Common Chemistry
	284.6039999999999 g/mol	RDKit
	284.604 g/mol	RDKit
Density	0.80 g/cm³	CAS Common Chemistry
	0.799 g/cm3	CAS Common Chemistry
Canonical SMILES	CCCCCC[SiH](CCCCCC)CCCCCC	CAS Common Chemistry
InChI	InChI=1S/C18H40Si/c1-4-7-10-13-16-19(17-14-11-8-5-2)18-15-12-9-6-3/h19H,4-18H2,1-3H3	CAS Common Chemistry
InChI Key	InChIKey=IBNSYFQZHBBNLR-UHFFFAOYSA-N	CAS Common Chemistry
Name	Trihexylsilane	CAS Common Chemistry
Heavy Atom Count	19	RDKit
Hydrogen Bond Acceptors	0	RDKit
Hydrogen Bond Donors	0	RDKit
Rotatable Bonds	15	RDKit
Aromatic Ring Count	0	RDKit
Topological Polar Surface Area	0.0 Å²	RDKit
LogP	6.954400000000007	RDKit
	6.9544	RDKit
	7.51	chempirical lib
Molar Refractivity	93.99600000000008 cm³/mol	RDKit
Ring Count	0	RDKit
Formal Charge	0	RDKit
Fraction Csp3	1.0	RDKit
Exact Mass	284.28992781 g/mol	RDKit
Boiling Point	160-161 °C @ 5 Torr	CAS Common Chemistry

NMR, IR, and Mass spectral data

Predicting NMR spectra...

10 ppm 9 8 7 6 5 4 3 2 1 0 ppm

Shift (ppm)	Multiplicity	Integration	Assignment

200 ppm 180 160 140 120 100 80 60 40 20 0 ppm

Shift (ppm)	DEPT	Assignment

Note: These NMR spectra are predicted computationally and may differ from experimental data. Predictions are based on chemical environment analysis.

Convert

MW = 284.60 g/mol; density = 0.800 g/mL. Edit any field — others recompute live.

Mass (g) Moles (mmol) Moles (mol) Volume (mL)