Chemical Properties of Cyclohexanone, 4-methyl- (CAS 589-92-4)

Cyclohexanone, 4-methyl-

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InChI
InChI=1S/C7H12O/c1-6-2-4-7(8)5-3-6/h6H,2-5H2,1H3
InChI Key
VGVHNLRUAMRIEW-UHFFFAOYSA-N
Formula
C7H12O
SMILES
CC1CCC(=O)CC1
Molecular Weight1
112.17
CAS
589-92-4
Other Names
  • 4-Methylcyclohexanone
  • p-Methyl cyclohexanone
  • 4-Methyl-1-cyclohexanone
  • Methyl-4 cyclohexanone-1
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Physical Properties

Property Value Unit Source
PAff 844.90 kJ/mol NIST
BasG 813.00 kJ/mol NIST
EA 0.01 ± 0.00 eV NIST
Δf -90.08 kJ/mol Joback Calculated Property
Δfgas -271.19 kJ/mol Joback Calculated Property
Δfus 5.23 kJ/mol Joback Calculated Property
Δvap 35.85 kJ/mol Joback Calculated Property
IE 9.16 eV NIST
log10WS -1.69 Crippen Calculated Property
logPoct/wat 1.766 Crippen Calculated Property
McVol 100.200 ml/mol McGowan Calculated Property
Pc 3673.09 kPa Joback Calculated Property
Inp [918.00; 968.00]   Show Hide
Inp 943.00 NIST
Inp 945.00 NIST
Inp 936.00 NIST
Inp 939.00 NIST
Inp 954.00 NIST
Inp 968.00 NIST
Inp 950.00 NIST
Inp 923.00 NIST
Inp 918.00 NIST
Inp 937.00 NIST
Inp 945.00 NIST
Inp 943.00 NIST
Inp 968.00 NIST
Inp 923.00 NIST
Inp 937.00 NIST
I [1339.00; 1376.00]   Show Hide
I 1342.00 NIST
I 1348.00 NIST
I 1348.00 NIST
I 1339.00 NIST
I 1376.00 NIST
Tboil [373.50; 444.60] K Show Hide
Tboil 443.20 K NIST
Tboil 444.60 ± 0.60 K NIST
Tboil 373.50 ± 1.00 K NIST
Tc 670.65 K Joback Calculated Property
Tfus [232.00; 232.55] K Show Hide
Tfus 232.55 ± 0.50 K NIST
Tfus 232.00 ± 5.00 K NIST
Vc 0.367 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [206.20; 227.80] J/mol×K [445.00; 500.00] Show Hide
Cp,gas 206.20 ± 0.80 J/mol×K 445.00 NIST
Cp,gas 211.30 ± 1.20 J/mol×K 450.00 NIST
Cp,gas 215.70 ± 1.60 J/mol×K 460.00 NIST
Cp,gas 218.80 ± 1.60 J/mol×K 470.00 NIST
Cp,gas 221.80 ± 1.80 J/mol×K 480.00 NIST
Cp,gas 224.80 ± 2.00 J/mol×K 490.00 NIST
Cp,gas 227.80 ± 2.50 J/mol×K 500.00 NIST
Cp,liquid 207.10 J/mol×K 290.00 NIST
ΔvapH 45.30 kJ/mol 391.50 NIST

Similar Compounds

Cyclohexanone, 4-methyl-. Cyclohexanone, 4-ethyl-. 4-Propylcyclohexanone. 2-Heptanone, 5-methyl-. Cycloheptanone, 4-methyl-, (R)-. 5-Nonanone, 2,8-dimethyl-. 3-Heptanone, 6-methyl-. 5-Undecanone, 2-methyl-. 5-Decanone, 2-methyl-. 5-Nonanone, 2-methyl-. 4-Octanone, 7-methyl-. 4-Isopropylcyclohexanone. Cyclohexanone, 3-methyl-, (R)-. Cyclohexanone, 3-methyl-, (S)-. Cyclohexanone, 3-methyl-.

Find more compounds similar to Cyclohexanone, 4-methyl-.

Sources

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