Chemical Properties of Cyclopropanecarboxylic acid, 2,2-dimethyl-3-(2-methyl-1-propenyl)-, 2-methyl-4-oxo-3-(2-pentenyl)-2-cyclopenten-1-yl ester, [1R-[1«alpha»[S*(Z)],3«beta»]]- (CAS 4466-14-2)

Cyclopropanecarboxylic acid, 2,2-dimethyl-3-(2-methyl-1-propenyl)-, 2-methyl-4-oxo-3-(2-pentenyl)-2-cyclopenten-1-yl ester, [1R-[1«alpha»[S*(Z)],3«beta»]]-

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InChI
InChI=1S/C21H30O3/c1-7-8-9-10-15-14(4)18(12-17(15)22)24-20(23)19-16(11-13(2)3)21(19,5)6/h8-9,11,16,18-19H,7,10,12H2,1-6H3/b9-8+
InChI Key
NZKIRHFOLVYKFT-CMDGGOBGSA-N
Formula
C21H30O3
SMILES
CCC=CCC1=C(C)C(OC(=O)C2C(C=C(C)C)C2(C)C)CC1=O
Molecular Weight1
330.46
CAS
4466-14-2
Other Names
  • Cyclopropanecarboxylic acid, 2,2-dimethyl-3-(2-methylpropenyl)-, ester with 4-hydroxy-3-methyl-2-(2-pentenyl)-2-cyclopenten-1-one
  • Cyclopropanecarboxylic acid, 2,2-dimethyl-3-(2-methyl-1-propenyl)-, 2-methyl-4-oxo-3-(2-pentenyl)-2-cyclopenten-1-yl ester
  • Jasmolin I
  • Jasmoline I
  • Pyrethrin (Jasmolin I)
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Physical Properties

Property Value Unit Source
ω 0.5653 Relay (... Calculated Property
ΔfG° 8.41 kJ/mol Joback Calculated Property
ΔfH°gas -561.91 kJ/mol Relay (... Calculated Property
ΔfusH° 39.89 kJ/mol Joback Calculated Property
ΔvapH° 91.97 kJ/mol Relay (... Calculated Property
IE 8.46 eV Relay (... Calculated Property
log10WS -4.66 Relay (... Calculated Property
logPoct/wat 4.782 Crippen Calculated Property
McVol 281.140 ml/mol McGowan Calculated Property
Pc 1323.28 kPa Joback Calculated Property
Tboil 589.93 K Relay (... Calculated Property
Tc 839.36 K Relay (... Calculated Property
Tfus 342.29 K Relay (... Calculated Property
Vc 0.965 m3/kmol Relay (... Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [914.13; 1033.56] J/mol×K [854.23; 1074.28] Show Hide
Cp,gas 914.13 J/mol×K 854.23 Joback Calculated Property
Cp,gas 935.02 J/mol×K 890.90 Joback Calculated Property
Cp,gas 955.32 J/mol×K 927.58 Joback Calculated Property
Cp,gas 975.18 J/mol×K 964.25 Joback Calculated Property
Cp,gas 994.74 J/mol×K 1000.93 Joback Calculated Property
Cp,gas 1014.16 J/mol×K 1037.60 Joback Calculated Property
Cp,gas 1033.56 J/mol×K 1074.28 Joback Calculated Property

Similar Compounds

Cinerin I. Cyclopropanecarboxylic acid, 3-(3-methoxy-2-methyl-3-oxo-1-propenyl)-2,2-dimethyl-, 2-methyl-4-oxo-3-(2-pentenyl)-2-cyclopenten-1-yl ester, [1R-[1«alpha»[S*(Z)],3«beta»(E)]]-. Cyclopropanecarboxylic acid, 2,2-dimethyl-3-(2-methyl-1-propenyl)-, 2-methyl-4-oxo-3-(2-propenyl)-2-cyclopenten-1-yl ester. Bioallethrin. Allethrin, isomers 1,2. Allethrin, isomers 3,4. Cyclopropanecarboxylic acid, 2,2-dimethyl-3-(2-methyl-1-propenyl)-, 2-methyl-4-oxo-3-(2,4-pentadienyl)-2-cyclopenten-1-yl ester, [1R-[1«alpha»[S*(Z)],3«beta»]]-. Pyrethrin II. O-Acetylcrotavernine. Digoxin (L1=41,8mg/mL, L2=68,2mg/mL, Z=40,1mg/mL). Digitoxin. Thymidine, 3'-O-cyclotetramethylene-tertbutylsilyl, 5'-O-TMS. Thymidine, 3'-O-cyclotetramethylene-isopropylsilyl, 5'-O-cyclotetramethylene-tertbutylsilyl. Thymidine, 3'-O-TMS, 5'-O-cyclotetramethylene-isopropylsilyl. Thymidine, 3'-O-cyclotetramethylene-tertbutylsilyl, 5'-O-TBDMS.

Find more compounds similar to Cyclopropanecarboxylic acid, 2,2-dimethyl-3-(2-methyl-1-propenyl)-, 2-methyl-4-oxo-3-(2-pentenyl)-2-cyclopenten-1-yl ester, [1R-[1«alpha»[S*(Z)],3«beta»]]-.

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