Chemical Properties of Allyl isovalerate (CAS 2835-39-4)

Allyl isovalerate

PDF Excel Molecule Calculator
InChI
InChI=1S/C8H14O2/c1-4-5-10-8(9)6-7(2)3/h4,7H,1,5-6H2,2-3H3
InChI Key
HOMAGVUCNZNWBC-UHFFFAOYSA-N
Formula
C8H14O2
SMILES
C=CCOC(=O)CC(C)C
Molecular Weight1
142.20
CAS
2835-39-4
Other Names
  • 2-Propenyl 3-methylbutanoate
  • 2-Propenyl isovalerate
  • 3-Methylbutanoic acid, 2-propenyl ester
  • 3-Methylbutyric acid, allyl ester
  • Allyl 3-methylbutyrate
  • Allyl isopentanoate
  • Allyl isovalerianate
  • Butanoic acid, 3-methyl-, 2-propen-1-yl ester
  • Butanoic acid, 3-methyl-, 2-propenyl ester
  • Butyric acid, 3-methyl-, allyl ester
  • FEMA No. 2045
  • Isovaleric acid, allyl ester
  • NCI-C54717
  • NSC 18606
Cheméo is a service of Céondo GmbH, since 2007, we provide simulation, modelling and software development services for the industry. Do not hesitate to contact us for your projects.

Physical Properties

Property Value Unit Source
Δf -132.04 kJ/mol Joback Calculated Property
Δfgas -333.10 kJ/mol Joback Calculated Property
Δfus 14.46 kJ/mol Joback Calculated Property
Δvap 41.50 kJ/mol Joback Calculated Property
log10WS -1.65 Crippen Calculated Property
logPoct/wat 1.762 Crippen Calculated Property
McVol 126.720 ml/mol McGowan Calculated Property
Pc 2799.47 kPa Joback Calculated Property
Inp [915.00; 920.00]   Show Hide
Inp 915.00 NIST
Inp 920.00 NIST
Inp 915.00 NIST
Inp 915.00 NIST
Inp 920.00 NIST
I [1190.00; 1190.00]   Show Hide
I 1190.00 NIST
I 1190.00 NIST
Tboil 454.97 K Joback Calculated Property
Tc 637.48 K Joback Calculated Property
Tfus 235.32 K Joback Calculated Property
Vc 0.482 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [263.19; 328.12] J/mol×K [454.97; 637.48] Show Hide
Cp,gas 263.19 J/mol×K 454.97 Joback Calculated Property
Cp,gas 275.17 J/mol×K 485.39 Joback Calculated Property
Cp,gas 286.67 J/mol×K 515.81 Joback Calculated Property
Cp,gas 297.72 J/mol×K 546.22 Joback Calculated Property
Cp,gas 308.30 J/mol×K 576.64 Joback Calculated Property
Cp,gas 318.44 J/mol×K 607.06 Joback Calculated Property
Cp,gas 328.12 J/mol×K 637.48 Joback Calculated Property
η [0.0002428; 0.0043324] Pa×s [235.32; 454.97] Show Hide
η 0.0043324 Pa×s 235.32 Joback Calculated Property
η 0.0019397 Pa×s 271.93 Joback Calculated Property
η 0.0010509 Pa×s 308.54 Joback Calculated Property
η 0.0006484 Pa×s 345.14 Joback Calculated Property
η 0.0004389 Pa×s 381.75 Joback Calculated Property
η 0.0003181 Pa×s 418.36 Joback Calculated Property
η 0.0002428 Pa×s 454.97 Joback Calculated Property

Correlations

Property Value Unit Temperature (K) Source
Pvap [1.33; 202.63] kPa [390.00; 538.49] The Yaw... Show Hide
Equationln(Pvp) = A + B/(T + C)
Coefficient A1.57003e+01
Coefficient B-4.73278e+03
Coefficient C-8.29300e+01
Temperature range, min.390.00
Temperature range, max.538.49
Pvap 1.33 kPa 390.00 Calculated Property
Pvap 2.93 kPa 406.50 Calculated Property
Pvap 5.95 kPa 423.00 Calculated Property
Pvap 11.33 kPa 439.50 Calculated Property
Pvap 20.37 kPa 456.00 Calculated Property
Pvap 34.86 kPa 472.49 Calculated Property
Pvap 57.11 kPa 488.99 Calculated Property
Pvap 90.03 kPa 505.49 Calculated Property
Pvap 137.14 kPa 521.99 Calculated Property
Pvap 202.63 kPa 538.49 Calculated Property

Similar Compounds

Butanoic acid, 2-propenyl ester. (E,Z)-2,8-Decadien-4,6-diyn-1-yl 3-methylbutanoate. Butanoic acid, 3-methyl-, ethyl ester. 3-methylbut-2-en-1-yl 3-methylbutanoate. Pentanoic acid, 2-propenyl ester. Diallyl glutarate. Butanoic acid, 3-chloro, 2-propenyl ester. Ethanol, 2-chloro, 3-methylbutanoate. Butanoic acid, 3-chloroprop-2-enyl ester. Butanoic acid, 3-methyl, 2-bromoethyl ester. Butanoic acid, 3-methyl, 2-iodoethyl ester. Hexanoic acid, 2-propenyl ester. Isovaleric acid, 2,2,2-trichloroethyl ester. Butanoic acid, 3-methyl-, propyl ester. Allyl heptanoate.

Find more compounds similar to Allyl isovalerate.

Sources

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.