Chemical Properties of 4-Bis[(tert-butyldimethylsilyl)oxy]phosphoryl-N-(tert-butyldimethylsilyl)butan-1-amine

InChI

InChI=1S/C22H54NO3PSi3/c1-20(2,3)28(10,11)23-18-16-17-19-27(24,25-29(12,13)21(4,5)6)26-30(14,15)22(7,8)9/h23H,16-19H2,1-15H3

InChI Key

VJADKNFWVFEYJP-UHFFFAOYSA-N

Formula

C22H54NO3PSi3

SMILES

CC(C)(C)[Si](C)(C)NCCCCP(=O)(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C

Molecular Weight¹

495.90

Other Names

• Bis(tert-butyldimethylsilyl) 4-[(tert-butyldimethylsilyl)amino]butylphosphonate
• Phosphonic acid, [4-[(tert-butyldimethylsilyl)amino]buytl]-, bis(tert-butyldimethylsilyl) ester

• ω : Acentric Factor.
• Δ_fG° : Standard Gibbs free energy of formation (kJ/mol).
• Δ_fH°_gas : Enthalpy of formation at standard conditions (kJ/mol).
• Δ_vapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
• IE : Ionization energy (eV).
• log₁₀WS : Log10 of Water solubility in mol/l.
• logP_oct/wat : Octanol/Water partition coefficient.
• P_c : Critical Pressure (kPa).
• I_np : Non-polar retention indices.
• T_boil : Normal Boiling Point Temperature (K).
• T_c : Critical Temperature (K).
• T_fus : Normal melting (fusion) point (K).
• V_c : Critical Volume (m³/kmol).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
ω	0.8238		Relay (1.0) Calculated Property
ΔfG°	-108.23	kJ/mol	Relay (1.0-beta) Calculated Property
ΔfH°gas	-1188.10	kJ/mol	Relay (1.0) Calculated Property
ΔvapH°	78.98	kJ/mol	Relay (1.0) Calculated Property
IE	7.47	eV	Relay (1.0) Calculated Property
log10WS	-4.13		Relay (1.0) Calculated Property
logPoct/wat	8.598		Crippen Calculated Property
Pc	975.07	kPa	Relay (1.0-beta) Calculated Property
Inp	[2433.00; 2433.00]
Inp	2433.00		NIST
Inp	2433.00		NIST
Tboil	629.91	K	Relay (1.0) Calculated Property
Tc	842.77	K	Relay (1.0) Calculated Property
Tfus	342.46	K	Relay (1.0) Calculated Property
Vc	1.715	m3/kmol	Relay (1.0) Calculated Property

Similar Compounds

Find more compounds similar to 4-Bis[(tert-butyldimethylsilyl)oxy]phosphoryl-N-(tert-butyldimethylsilyl)butan-1-amine.

Sources

• Cheméo Relay (1.0)
• Cheméo Relay (1.0, beta) Beta: served but experimental, data-limited and below our cross-validation release bar; the Joback value is recommended where available.
• Crippen Method
• Crippen Method
• NIST Webbook

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