Chemical Properties of Nerolidyl acetate (CAS 2306-78-7)

Nerolidyl acetate

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InChI
InChI=1S/C17H28O2/c1-7-17(6,19-16(5)18)13-9-12-15(4)11-8-10-14(2)3/h7,10,12H,1,8-9,11,13H2,2-6H3
InChI Key
PRNJXUQTUSFYLV-UHFFFAOYSA-N
Formula
C17H28O2
SMILES
C=CC(C)(CCC=C(C)CCC=C(C)C)OC(C)=O
Molecular Weight1
264.40
CAS
2306-78-7
Other Names
  • 1,6,10-Dodecatrien-3-ol, 3,7,11-trimethyl-, acetate
  • Nerolidol, acetate
  • 3,7,11-Trimethyl-1,6,10-dodecatrien-3-yl acetate
  • 3,7,11-trimethyldodeca-1,6,10-trien-3-yl acetate
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Physical Properties

Property Value Unit Source
Δf 92.36 kJ/mol Joback Calculated Property
Δfgas -307.47 kJ/mol Joback Calculated Property
Δfus 31.66 kJ/mol Joback Calculated Property
Δvap 60.70 kJ/mol Joback Calculated Property
log10WS -5.47 Crippen Calculated Property
logPoct/wat 4.967 Crippen Calculated Property
McVol 244.930 ml/mol McGowan Calculated Property
Pc 1446.83 kPa Joback Calculated Property
Inp [1687.00; 1687.00]   Show Hide
Inp 1687.00 NIST
Inp 1687.00 NIST
I [2271.00; 2271.00]   Show Hide
I 2271.00 NIST
I 2271.00 NIST
I 2271.00 NIST
Tboil 666.18 K Joback Calculated Property
Tc 858.25 K Joback Calculated Property
Tfus 316.09 K Joback Calculated Property
Vc 0.944 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [667.79; 761.92] J/mol×K [666.18; 858.25] Show Hide
Cp,gas 667.79 J/mol×K 666.18 Joback Calculated Property
Cp,gas 685.72 J/mol×K 698.19 Joback Calculated Property
Cp,gas 702.68 J/mol×K 730.20 Joback Calculated Property
Cp,gas 718.71 J/mol×K 762.22 Joback Calculated Property
Cp,gas 733.89 J/mol×K 794.23 Joback Calculated Property
Cp,gas 748.27 J/mol×K 826.24 Joback Calculated Property
Cp,gas 761.92 J/mol×K 858.25 Joback Calculated Property

Similar Compounds

trans-Nerolidyl Acetate. (Z)-Nerolidyl acetate. Nerolidyl propionate. (Z)-Nerolidol acetate. 1,5-dimethyl-1-vinylhept-4-enyl acetate. Linalyl acetate. 1,6-Octadien-3-ol, 3,7-dimethyl-, propanoate. 1,5-Dimethyl-1-vinyl-4-hexenyl butyrate. Formic acid, 3,7,11-trimethyl-1,6,10-dodecatrien-3-yl ester. Butanoic acid, 3-methyl-, 1-ethenyl-1,5-dimethyl-4-hexenyl ester. Linalyl isobutyrate. Pentanoic acid, 1-ethenyl-1,5-dimethyl-4-hexenyl ester. Hexanoic acid, 1-ethenyl-1,5-dimethyl-4-hexenyl ester. Linalyl heptanoate. linalyl 3-methylhexanoate.

Find more compounds similar to Nerolidyl acetate.

Sources

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