Chemical Properties of 2-Methoxyethoxycyclododecane (Ambrolignan)

2-Methoxyethoxycyclododecane (Ambrolignan)

InChI
InChI=1S/C15H30O2/c1-3-17-15-13-11-9-7-5-4-6-8-10-12-14(15)16-2/h14-15H,3-13H2,1-2H3
InChI Key
QEESDNRMTAWNFQ-UHFFFAOYSA-N
Formula
C15H30O2
SMILES
CCOC1CCCCCCCCCCC1OC
Molecular Weight1
242.40
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Physical Properties

Property Value Unit Source
ΔfusH° 17.29 kJ/mol Joback Calculated Property
IE 8.99 eV Relay (1.0) Calculated Property
logPoct/wat 4.321 Crippen Calculated Property
McVol 223.090 ml/mol McGowan Calculated Property
Inp [1750.20; 1779.20]   Show Hide
Inp 1750.20 NIST
Inp 1762.80 NIST
Inp 1779.20 NIST
Inp 1750.20 NIST
Inp 1762.80 NIST
Inp 1779.20 NIST
Ip [2102.70; 2156.80]   Show Hide
Ip 2102.70 NIST
Ip 2127.80 NIST
Ip 2156.80 NIST
Ip 2102.70 NIST
Ip 2127.80 NIST
Ip 2156.80 NIST
Ip 2102.70 NIST
Ip 2156.80 NIST
Tboil 588.94 K Relay (1.0) Calculated Property
Tfus 270.58 K Relay (1.0) Calculated Property

Cheméo can also estimate 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, 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 [289.29; 832.60] J/mol×K [273.00; 1000.00] Joback Predicted correlation Show Hide
EquationY = A + B·T + C·T² + D·T³ + E·T⁴
Y is Cp,gas in J/mol×K, T in K
Coefficient A-5.01390e+01
Coefficient B1.34044e+00
Coefficient C-3.17400e-04
Coefficient D-1.40300e-07
Coefficient E0.00000e+00
Temperature range, min.273.00
Temperature range, max.1000.00
Cp,gas 289.29 J/mol×K 273.00 Calculated Property
Cp,gas 378.14 J/mol×K 353.78 Calculated Property
Cp,gas 460.91 J/mol×K 434.56 Calculated Property
Cp,gas 537.14 J/mol×K 515.33 Calculated Property
Cp,gas 606.41 J/mol×K 596.11 Calculated Property
Cp,gas 668.25 J/mol×K 676.89 Calculated Property
Cp,gas 722.24 J/mol×K 757.67 Calculated Property
Cp,gas 767.92 J/mol×K 838.44 Calculated Property
Cp,gas 804.86 J/mol×K 919.22 Calculated Property
Cp,gas 832.60 J/mol×K 1000.00 Calculated Property
Property Value Unit Temperature (K) Source
η [0.0095734; 0.0000322] Pa×s [285.29; 594.30] Joback Predicted correlation Show Hide
EquationY = exp(A + B/T + C·ln(T) + D·T^E)
Y is η in Pa×s, T in K
Coefficient A-1.55984e+01
Coefficient B3.12382e+03
Coefficient C0.00000e+00
Coefficient D0.00000e+00
Coefficient E0.00000e+00
CommentLiquid phase. Joback/Reid (1987), valid from Tf to 0.7·Tc.
Temperature range, min.285.29
Temperature range, max.594.30
η 0.0095734 Pa×s 285.29 Calculated Property
η 0.0029528 Pa×s 319.62 Calculated Property
η 0.0011442 Pa×s 353.96 Calculated Property
η 0.0005243 Pa×s 388.29 Calculated Property
η 0.0002727 Pa×s 422.63 Calculated Property
η 0.0001565 Pa×s 456.96 Calculated Property
η 0.0000971 Pa×s 491.30 Calculated Property
η 0.0000641 Pa×s 525.63 Calculated Property
η 0.0000445 Pa×s 559.97 Calculated Property
η 0.0000322 Pa×s 594.30 Calculated Property

Similar Compounds

Dibenzo[b,k][1,4,7,10,13,16]hexaoxacyclooctadecin, eicosahydro-. Cyclohexane, 1,2-dimethoxy-, cis-. Cyclohexane, 1,2-dimethoxy-, trans-. 1,5-anhydro-2,3,4-tri-O-methyl-D-fucitol. 1,5-Anhydro-2,3,4-tri-O-methyl-L-rhamnitol. Furan, tetrahydro-2-(methoxymethyl)-. (2R,7S)-diacetoxytridecane. Cyclopentane, 1,2-dimethoxy-,cis-. Cyclopentane, 1,2-dimethoxy-, trans-. 1,5-Anhydro-2,3,4,6-tetra-O-methyl-D-mannitol. 1,5-Anhydro-2,3,4,6-tetra-O-methyl-D-glucitol. 1,5-Anhydro-2,3,4,6-tetra-O-methyl-D-galactitol. 1,2-Cyclohexanediol diacetate, trans-. 1,2-Cyclohexanol diacetate, cis-. 1,4-Anhydro-2,3,5-tri-O-methyl-L-fucitol.

Find more compounds similar to 2-Methoxyethoxycyclododecane (Ambrolignan).

Sources

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