Chemical Properties of (2E,6E,10E)-3,7,11,15-Tetramethylhexadeca-2,6,10,14-tetraen-1-yl formate (CAS 125456-63-5)

(2E,6E,10E)-3,7,11,15-Tetramethylhexadeca-2,6,10,14-tetraen-1-yl formate

Download as PDF file Download as Excel file Download as 2D mole file Predict properties

InChI
InChI=1S/C21H34O2/c1-18(2)9-6-10-19(3)11-7-12-20(4)13-8-14-21(5)15-16-23-17-22/h9,11,13,15,17H,6-8,10,12,14,16H2,1-5H3/b19-11+,20-13+,21-15+
InChI Key
YCTKONHGXCYDJD-YKBIRWAZSA-N
Formula
C21H34O2
SMILES
CC(C)=CCCC(C)=CCCC(C)=CCCC(C)=CCOC=O
Molecular Weight1
318.49
CAS
125456-63-5
Sources

Physical Properties

Property Value Unit Source
Δf 208.10 kJ/mol Joback Calculated Property
Δfgas -264.85 kJ/mol Joback Calculated Property
Δfus 49.19 kJ/mol Joback Calculated Property
Δvap 71.62 kJ/mol Joback Calculated Property
logPoct/wat 6.31 Crippen Calculated Property
Pc 1149.87 kPa Joback Calculated Property
Tboil 767.12 K Joback Calculated Property
Tc 957.97 K Joback Calculated Property
Tfus 314.50 K Joback Calculated Property
Vc 1.17 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 871.04 J/mol×K 767.12 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
-O- (nonring) 1
=C< 4
-CH2- 7
O=CH- (aldehyde) 1
-CH3 5
=CH- 4

Similar Compounds

Farnesol formate. Geranyl formate. Neryl formate. Farnesol (e), methyl ether. (Z)-Farnesyl acetate. (Z,E)-Farnesyl acetate. 2,6,10-Dodecatrien-1-ol, 3,7,11-trimethyl-, acetate, (E,E)-. Farnesyl acetate. (E,Z)-farnesyl acetate. 2,6,10,14-Hexadecatetraen-1-ol, 3,7,11,15-tetramethyl-, acetate, (E,E,E)-. Nerol, methyl ether. (2E)-1-Methoxy-3,7-dimethylocta-2,6-diene. 2,6-Octadien-1-ol, 3,7-dimethyl-, acetate. 2,6-Octadien-1-ol, 3,7-dimethyl-, acetate, (Z)-. Acetic acid, geranyl ester.

Find more compounds similar to (2E,6E,10E)-3,7,11,15-Tetramethylhexadeca-2,6,10,14-tetraen-1-yl formate.

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.