Chemical Properties of L-rhamnose, acetylated diethyldithioacetal derivative

InChI

InChI=1S/C18H30O8S2/c1-8-27-18(28-9-2)17(26-14(7)22)16(25-13(6)21)15(24-12(5)20)10(3)23-11(4)19/h10,15-18H,8-9H2,1-7H3/t10-,15-,16+,17+/m1/s1

InChI Key

IGZAPMUTZWRKTE-XLUQRUARSA-N

Formula

C18H30O8S2

SMILES

CCSC(SCC)C(OC(C)=O)C(OC(C)=O)C(OC(C)=O)C(C)OC(C)=O

Molecular Weight¹

438.56

• ω : Acentric Factor.
• C_p,gas : Ideal gas heat capacity (J/mol×K).
• Δ_fG° : Standard Gibbs free energy of formation (kJ/mol).
• Δ_fH°_gas : Enthalpy of formation at standard conditions (kJ/mol).
• Δ_fusH° : Enthalpy of fusion 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.
• McVol : McGowan's characteristic volume (ml/mol).
• 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	0.7957		Relay (1.0) Calculated Property
ΔfG°	-780.96	kJ/mol	Joback Calculated Property
ΔfH°gas	-1592.21	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	44.17	kJ/mol	Joback Calculated Property
ΔvapH°	116.92	kJ/mol	Relay (1.0) Calculated Property
IE	8.14	eV	Relay (1.0) Calculated Property
log10WS	-2.11		Relay (1.0) Calculated Property
logPoct/wat	2.565		Crippen Calculated Property
McVol	326.940	ml/mol	McGowan Calculated Property
Pc	1384.02	kPa	Joback Calculated Property
Inp	[2226.00; 2226.00]
Inp	2226.00		NIST
Inp	2226.00		NIST
Tboil	638.45	K	Relay (1.0) Calculated Property
Tc	806.08	K	Relay (1.0) Calculated Property
Tfus	317.82	K	Relay (1.0) Calculated Property
Vc	1.133	m3/kmol	Relay (1.0) Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[1047.17; 1063.42]	J/mol×K	[1051.76; 1288.34]
Cp,gas	1047.17	J/mol×K	1051.76	Joback Calculated Property
Cp,gas	1054.69	J/mol×K	1091.19	Joback Calculated Property
Cp,gas	1059.93	J/mol×K	1130.62	Joback Calculated Property
Cp,gas	1062.86	J/mol×K	1170.05	Joback Calculated Property
Cp,gas	1063.42	J/mol×K	1209.48	Joback Calculated Property
Cp,gas	1061.59	J/mol×K	1248.91	Joback Calculated Property
Cp,gas	1057.31	J/mol×K	1288.34	Joback Calculated Property

Similar Compounds

Find more compounds similar to L-rhamnose, acetylated diethyldithioacetal derivative.

Sources

• Cheméo Relay (1.0)
• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

Note: Cheméo is only indexing the data, follow the source links to retrieve the latest data. The source is also providing more information like the publication year, authors and more. Take the time to validate and double check the source of the data.