Chemical Properties of 1-Propanol, DMTBS

InChI

InChI=1S/C9H22OSi/c1-7-8-10-11(5,6)9(2,3)4/h7-8H2,1-6H3

InChI Key

FPTCHHKCUSVAOO-UHFFFAOYSA-N

Formula

C9H22OSi

SMILES

CCCO[Si](C)(C)C(C)(C)C

Molecular Weight¹

174.36

Other Names

• 1-Propanol, O-TBDMS

• 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.
• I : 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	0.3898		Relay (1.0) Calculated Property
ΔfG°	-66.99	kJ/mol	Relay (1.0-beta) Calculated Property
ΔfH°gas	-453.21	kJ/mol	Relay (1.0) Calculated Property
ΔvapH°	42.34	kJ/mol	Relay (1.0) Calculated Property
IE	9.15	eV	Relay (1.0) Calculated Property
log10WS	-1.75		Relay (1.0) Calculated Property
logPoct/wat	3.418		Crippen Calculated Property
Pc	2278.34	kPa	Relay (1.0-beta) Calculated Property
Inp	[907.00; 907.00]
Inp	907.00		NIST
Inp	907.00		NIST
Inp	907.00		NIST
I	[919.00; 919.00]
I	919.00		NIST
I	919.00		NIST
Tboil	432.51	K	Relay (1.0) Calculated Property
Tc	605.66	K	Relay (1.0) Calculated Property
Tfus	212.40	K	Relay (1.0) Calculated Property
Vc	0.604	m3/kmol	Relay (1.0) Calculated Property

Similar Compounds

Find more compounds similar to 1-Propanol, DMTBS.

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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