Chemical Properties of 2-Phenylethanol, rutinoside, TFA

2-Phenylethanol, rutinoside, TFA

InChI
InChI=1S/C32H24F18O16/c1-10-13(61-21(51)27(33,34)35)15(63-23(53)29(39,40)41)17(65-25(55)31(45,46)47)20(59-10)58-9-12-14(62-22(52)28(36,37)38)16(64-24(54)30(42,43)44)18(66-26(56)32(48,49)50)19(60-12)57-8-7-11-5-3-2-4-6-11/h2-6,10,12-20H,7-9H2,1H3/t10-,12+,13-,14+,15+,16-,17+,18+,19+,20+/m1/s1
InChI Key
XTZBPLHRZJNARN-PBAYVUIYSA-N
Formula
C32H24F18O16
SMILES
CC1OC(OCC2OC(OCCc3ccccc3)C(OC(=O)C(F)(F)F)C(OC(=O)C(F)(F)F)C2OC(=O)C(F)(F)F)C(OC(=O)C(F)(F)F)C(OC(=O)C(F)(F)F)C1OC(=O)C(F)(F)F
Molecular Weight1
1006.49
Other Names
  • Phenethyl alcohol, Rut, TFA
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Physical Properties

Property Value Unit Source
ΔfusH° 110.93 kJ/mol Joback Calculated Property
logPoct/wat 4.577 Crippen Calculated Property
McVol 516.240 ml/mol McGowan Calculated Property
Inp [2184.00; 2201.00]   Show Hide
Inp Outlier 2201.00 NIST
Inp 2184.00 NIST
Inp 2191.00 NIST
Inp 2184.00 NIST
Inp 2191.00 NIST
Inp 2191.00 NIST
Inp 2184.00 NIST

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Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [993.33; 1778.49] J/mol×K [1483.94; 2226.22] Show Hide
Cp,gas 1778.49 J/mol×K 1483.94 Joback Calculated Property
Cp,gas 1696.89 J/mol×K 1607.65 Joback Calculated Property
Cp,gas 1592.39 J/mol×K 1731.37 Joback Calculated Property
Cp,gas 1467.39 J/mol×K 1855.08 Joback Calculated Property
Cp,gas 1324.28 J/mol×K 1978.80 Joback Calculated Property
Cp,gas 1165.47 J/mol×K 2102.51 Joback Calculated Property
Cp,gas 993.33 J/mol×K 2226.22 Joback Calculated Property

Similar Compounds

2-Phenylethnol, «beta»-D-glucoside, TFA. «beta»-phenylethyl 6- O-(«beta»-D-apiofuranosyl)-«beta»-D-glucopyranoside, TFA. 2-Phenylethyl «beta»-D-glucopyranoside, TFA. Amigdalin, TFA. Sambunigrin, TFA. Prunasin, TFA. Benzyl alcohol, rutinoside, TFA. benzyl 6- O-(«alpha»-L-arabinofuranosyl)-«beta»-D-glucopyranoside, TFA. Benzenemethanol, Gly, TFA. Mandelonitrile, rhamnoglucoside (isomer # 2), TFA. Mandelonitrile, rhamnoglucoside (isomer # 1), TFA. Benzyl «beta»-D-glucopyranoside, TFA. Eugenol, .beta.-D-glucopyranoside, TFA. furanlinalyloxide 6- O-(«beta»-D-apiofuranosyl)-«beta»-D-glucopyranoside, TFA. N-Acetylnornarcotine.

Find more compounds similar to 2-Phenylethanol, rutinoside, TFA.

Sources

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Outlier This icon means that the value is more than 2 standard deviations away from the property mean.
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