Chemical Properties of Valerianol acetate

Valerianol acetate

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InChI
InChI=1S/C17H28O2/c1-12-7-6-8-14-9-10-15(11-17(12,14)5)16(3,4)19-13(2)18/h8,12,15H,6-7,9-11H2,1-5H3/t12-,15-,17+/m0/s1
InChI Key
KWFVLNZOTCEVEH-YLQAJVPDSA-N
Formula
C17H28O2
SMILES
CC(=O)OC(C)(C)C1CCC2=CCCC(C)C2(C)C1
Molecular Weight1
264.40
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Physical Properties

Property Value Unit Source
Δf -58.59 kJ/mol Joback Calculated Property
Δfgas -485.59 kJ/mol Joback Calculated Property
Δfus 18.64 kJ/mol Joback Calculated Property
Δvap 61.30 kJ/mol Joback Calculated Property
log10WS -4.83 Crippen Calculated Property
logPoct/wat 4.491 Crippen Calculated Property
McVol 231.810 ml/mol McGowan Calculated Property
Pc 1747.74 kPa Joback Calculated Property
Inp [1925.00; 1925.00]   Show Hide
Inp 1925.00 NIST
Inp 1925.00 NIST
Tboil 691.69 K Joback Calculated Property
Tc 916.62 K Joback Calculated Property
Tfus 410.67 K Joback Calculated Property
Vc 0.866 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [693.68; 813.02] J/mol×K [691.69; 916.62] Show Hide
Cp,gas 693.68 J/mol×K 691.69 Joback Calculated Property
Cp,gas 716.12 J/mol×K 729.18 Joback Calculated Property
Cp,gas 737.32 J/mol×K 766.67 Joback Calculated Property
Cp,gas 757.44 J/mol×K 804.16 Joback Calculated Property
Cp,gas 776.66 J/mol×K 841.65 Joback Calculated Property
Cp,gas 795.13 J/mol×K 879.14 Joback Calculated Property
Cp,gas 813.02 J/mol×K 916.62 Joback Calculated Property

Similar Compounds

«alpha»-Eudesmol acetate. «gamma»-eudesmol acetate. 10-epi-«gamma»-eudesmol acetate. «gamma»-Eudesmol acetate. «beta»-Eudesmol, acetate. Bulnesyl acetate. 3-Cyclohexene-1-methanol, «alpha»,«alpha»,4-trimethyl-, propanoate. «alpha»-Terpinyl acetate. «alpha»-Terpinyl acetate. Elemol acetate. 10A,12a-dimethyl-3,4,4a,5,6,9,10,10a,10b,11,12,12a-dodecahydro-2h-naphtho[2,1-f]chromene-2,8(4bh)-dione. Lanosta-9(11),24-dien-3-ol, acetate, (3«beta»)-. 24,24-Dimethyl-9(11),25-lanostadienol acetate. Epibauerenol (7-baueren-3A-ol) acetate. Bauerenol (7-bauerenenol) acetate.

Find more compounds similar to Valerianol acetate.

Sources

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