Chemical Properties of 3-Buten-1-ol, 3-methyl-, benzoate (CAS 5205-12-9)

3-Buten-1-ol, 3-methyl-, benzoate

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InChI
InChI=1S/C12H14O2/c1-10(2)8-9-14-12(13)11-6-4-3-5-7-11/h3-7H,1,8-9H2,2H3
InChI Key
BBTRQSDRTFFNSW-UHFFFAOYSA-N
Formula
C12H14O2
SMILES
C=C(C)CCOC(=O)c1ccccc1
Molecular Weight1
190.24
CAS
5205-12-9
Other Names
  • 3-Methyl-3-butenyl benzoate
  • 3-Methylbut-3-enyl benzoate
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Physical Properties

Property Value Unit Source
Δf 7.94 kJ/mol Joback Calculated Property
Δfgas -183.64 kJ/mol Joback Calculated Property
Δfus 21.07 kJ/mol Joback Calculated Property
Δvap 53.15 kJ/mol Joback Calculated Property
log10WS -3.24 Crippen Calculated Property
logPoct/wat 2.810 Crippen Calculated Property
McVol 159.320 ml/mol McGowan Calculated Property
Pc 2640.67 kPa Joback Calculated Property
Inp [1412.00; 1422.00]   Show Hide
Inp 1412.00 NIST
Inp 1422.00 NIST
Inp 1412.00 NIST
I [1993.00; 1993.00]   Show Hide
I 1993.00 NIST
I 1993.00 NIST
Tboil 573.49 K Joback Calculated Property
Tc 787.44 K Joback Calculated Property
Tfus 307.86 K Joback Calculated Property
Vc 0.606 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [373.59; 449.51] J/mol×K [573.49; 787.44] Show Hide
Cp,gas 373.59 J/mol×K 573.49 Joback Calculated Property
Cp,gas 388.37 J/mol×K 609.15 Joback Calculated Property
Cp,gas 402.26 J/mol×K 644.81 Joback Calculated Property
Cp,gas 415.28 J/mol×K 680.46 Joback Calculated Property
Cp,gas 427.48 J/mol×K 716.12 Joback Calculated Property
Cp,gas 438.88 J/mol×K 751.78 Joback Calculated Property
Cp,gas 449.51 J/mol×K 787.44 Joback Calculated Property

Similar Compounds

Bis(3-methylbut-3-enyl) phthalate. 3-Methylbut-3-enyl 3-chlorobenzoate. Phthalic acid, ethyl 3-methylbut-3-enyl ester. Phthalic acid, 3-methylbut-3-enyl propyl ester. 2-((3-Methylbut-3-enyloxy)carbonyl)benzoic acid. Phthalic acid, butyl 3-methylbut-3-enyl ester. Phthalic acid, isobutyl 3-methylbut-3-enyl ester. Phthalic acid, hexyl 3-methylbut-3-enyl ester. 3-Butenyl benzoate. Phthalic acid, heptyl 3-methylbut-3-enyl ester. Butyl benzoate. Phthalic acid, 3-methylbut-3-enyl nonyl ester. Phthalic acid, 3-methylbut-3-enyl tridecyl ester. Phthalic acid, 3-methylbut-3-enyl undecyl ester. Phthalic acid, 3-methylbut-3-enyl octyl ester.

Find more compounds similar to 3-Buten-1-ol, 3-methyl-, benzoate.

Sources

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