Chemical Properties of Laminaribiose, permethyl

InChI

InChI=1S/C19H36O11/c1-20-9-10-11(21-2)12(22-3)14(23-4)19(28-10)29-13-15(24-5)17(26-7)30-18(27-8)16(13)25-6/h10-19H,9H2,1-8H3/t10-,11-,12+,13-,14-,15-,16+,17?,18+,19+/m1/s1

InChI Key

QTKZSCCEFWDSLC-BDDBJPTBSA-N

Formula

C19H36O11

SMILES

COC[C@H]1O[C@@H](O[C@H]2[C@H](OC)[C@@H](OC)OC(OC)[C@@H]2OC)[C@H](OC)[C@@H](OC)[C@@H]1OC

Molecular Weight¹

440.49

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• η : Dynamic viscosity (Pa×s).
• Δ_fusH° : Enthalpy of fusion at standard conditions (kJ/mol).
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• I_np : Non-polar retention indices.
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
ΔfusH°	63.85	kJ/mol	Joback Calculated Property
logPoct/wat	-0.207		Crippen Calculated Property
McVol	321.420	ml/mol	McGowan Calculated Property
Inp	[2306.00; 2306.00]
Inp	2306.00		NIST
Inp	2306.00		NIST

Cheméo can also estimate Normal Boiling Point Temperature, Normal melting (fusion) point, Critical Temperature, Critical Pressure, Critical Volume, Enthalpy of formation at standard conditions, Enthalpy of vaporization at standard conditions, Standard Gibbs free energy of formation, Acentric Factor, Ionization energy, Log10 of Water solubility in mol/l for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.

Correlations

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[523.79; 1228.52]	J/mol×K	[273.00; 1000.00]	Joback Predicted correlation
Equation			Y = A + B·T + C·T² + D·T³ + E·T⁴ Y is Cp,gas in J/mol×K, T in K
Coefficient A			1.66061e+02
Coefficient B			1.26636e+00
Coefficient C			2.98200e-04
Coefficient D			-5.02100e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	523.79	J/mol×K	273.00	Calculated Property
Cp,gas	629.16	J/mol×K	353.78	Calculated Property
Cp,gas	731.47	J/mol×K	434.56	Calculated Property
Cp,gas	829.14	J/mol×K	515.33	Calculated Property
Cp,gas	920.56	J/mol×K	596.11	Calculated Property
Cp,gas	1004.16	J/mol×K	676.89	Calculated Property
Cp,gas	1078.34	J/mol×K	757.67	Calculated Property
Cp,gas	1141.52	J/mol×K	838.44	Calculated Property
Cp,gas	1192.11	J/mol×K	919.22	Calculated Property
Cp,gas	1228.52	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0002322; 0.0000799]	Pa×s	[537.94; 767.38]	Joback Predicted correlation
Equation			Y = exp(A + B/T + C·ln(T) + D·T^E) Y is η in Pa×s, T in K
Coefficient A			-1.19351e+01
Coefficient B			1.91905e+03
Coefficient C			0.00000e+00
Coefficient D			0.00000e+00
Coefficient E			0.00000e+00
Temperature range, min.			537.94
Temperature range, max.			767.38
η	0.0002322	Pa×s	537.94	Calculated Property
η	0.0001976	Pa×s	563.43	Calculated Property
η	0.0001705	Pa×s	588.93	Calculated Property
η	0.0001490	Pa×s	614.42	Calculated Property
η	0.0001315	Pa×s	639.91	Calculated Property
η	0.0001173	Pa×s	665.41	Calculated Property
η	0.0001054	Pa×s	690.90	Calculated Property
η	0.0000955	Pa×s	716.39	Calculated Property
η	0.0000871	Pa×s	741.89	Calculated Property
η	0.0000799	Pa×s	767.38	Calculated Property

Similar Compounds

Find more compounds similar to Laminaribiose, permethyl.

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
• 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.
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