Chemical Properties of 6-Octenoic acid, 3,7-dimethyl- (CAS 502-47-6)

6-Octenoic acid, 3,7-dimethyl-

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InChI
InChI=1S/C10H18O2/c1-8(2)5-4-6-9(3)7-10(11)12/h5,9H,4,6-7H2,1-3H3,(H,11,12)
InChI Key
GJWSUKYXUMVMGX-UHFFFAOYSA-N
Formula
C10H18O2
SMILES
CC(C)=CCCC(C)CC(=O)O
Molecular Weight1
170.25
CAS
502-47-6
Other Names
  • Citronellic acid
  • 3,7-Dimethyl-6-octenoic acid
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Physical Properties

Property Value Unit Source
Δf -163.19 kJ/mol Joback Calculated Property
Δfgas -412.39 kJ/mol Joback Calculated Property
Δfus 22.71 kJ/mol Joback Calculated Property
Δvap 60.93 kJ/mol Joback Calculated Property
log10WS -2.72 Crippen Calculated Property
logPoct/wat 2.844 Crippen Calculated Property
McVol 154.900 ml/mol McGowan Calculated Property
Pc 2608.40 kPa Joback Calculated Property
Inp [1260.00; 1345.40]   Show Hide
Inp 1340.80 NIST
Inp 1345.40 NIST
Inp 1260.00 NIST
Inp 1312.00 NIST
Inp 1314.00 NIST
Inp 1305.00 NIST
Inp 1287.00 NIST
Inp 1300.00 NIST
I [2232.00; 2257.00]   Show Hide
I 2255.00 NIST
I 2257.00 NIST
I 2232.00 NIST
Tboil 577.85 K Joback Calculated Property
Tc 756.62 K Joback Calculated Property
Tfus 279.17 K Joback Calculated Property
Vc 0.596 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [383.37; 449.16] J/mol×K [577.85; 756.62] Show Hide
Cp,gas 383.37 J/mol×K 577.85 Joback Calculated Property
Cp,gas 395.74 J/mol×K 607.65 Joback Calculated Property
Cp,gas 407.51 J/mol×K 637.44 Joback Calculated Property
Cp,gas 418.72 J/mol×K 667.24 Joback Calculated Property
Cp,gas 429.37 J/mol×K 697.03 Joback Calculated Property
Cp,gas 439.51 J/mol×K 726.83 Joback Calculated Property
Cp,gas 449.16 J/mol×K 756.62 Joback Calculated Property
ΔvapH 68.70 kJ/mol 451.00 NIST

Similar Compounds

(R)-(+)-Citronellic acid. 6-Octenoic acid, 3,7-dimethyl-, methyl ester. (S)-(-)-Citronellic acid, methyl ester. Citronellol. 6-Octen-1-ol, 3,7-dimethyl-, (R)-. (-)-3,7-dimethyloct-6-en-1-ol. (S)-(-)-Citronellic acid, trimethylsilyl ester. (R)-(+)-Citronellic acid, trimethylsilyl ester. Citronellic acid, trimethylsilyl ester. 2-(Cyclopenten-1-yl)acetic acid. 3,7-dimethyl-6-octenyl 3,7-dimethyloct-6-enoate. 9-Octadecenylsuccinic acid. Citronellyl hexanoate. Adipic acid, di(«beta»-citronellyl) ester. Citronellyl isoheptanoate.

Find more compounds similar to 6-Octenoic acid, 3,7-dimethyl-.

Sources

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