Chemical Properties of Chrysanthemic acid (CAS 10453-89-1)

Chrysanthemic acid

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InChI
InChI=1S/C10H16O2/c1-6(2)5-7-8(9(11)12)10(7,3)4/h5,7-8H,1-4H3,(H,11,12)
InChI Key
XLOPRKKSAJMMEW-UHFFFAOYSA-N
Formula
C10H16O2
SMILES
CC(C)=CC1C(C(=O)O)C1(C)C
Molecular Weight1
168.23
CAS
10453-89-1
Other Names
  • (.+/-.)-Chrysanthemumic acid
  • 2,2-Dimethyl-3-(2-methyl-1-propen-1-yl)cyclopropanecarboxylic acid (chrysanthemic acid)
  • 2,2-Dimethyl-3-(2-methyl-1-propenyl)cyclopropanecarboxylic acid
  • 2-(1-Isobutenyl)-3,3-dimethylcyclopropanecarboxylic acid
  • 3-Isobutenyl-2,2-dimethylcyclopropanecarboxylic acid
  • Chrysantemic acid
  • Chrysanthemumic acid
  • Chrysanthemummonocarboxylic acid
  • Cyclopropanecarboxylic acid, 2,2-dimethyl-3-(2-methyl-1-propenyl)-
  • Cyclopropanecarboxylic acid, 2,2-dimethyl-3-(2-methylpropenyl)-
  • NSC 11779
Sources

Physical Properties

Property Value Unit Source
Δf -120.91 kJ/mol Joback Calculated Property
Δfgas -359.75 kJ/mol Joback Calculated Property
Δfus 20.21 kJ/mol Joback Calculated Property
Δvap 59.46 kJ/mol Joback Calculated Property
logPoct/wat 2.31 Crippen Calculated Property
Pc 2899.85 kPa Joback Calculated Property
Tboil 575.93 K Joback Calculated Property
Tc 769.15 K Joback Calculated Property
Tfus 327.53 K Joback Calculated Property
Vc 0.55 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 370.33 J/mol×K 575.93 Joback Calculated Property
ΔfusH 14.51 kJ/mol 390.7 NIST

Molecular Descriptors

Joback and Reid Groups
=C< 1
-OH (alcohol) 1
=CH- 1
-CH3 4
>C< (ring) 1
>C=O (nonring) 1
>CH- (ring) 2

Similar Compounds

(1R-trans)-2,2-dimethyl-3-(2-methylprop-1-enyl)cyclopropanecarboxylic acid. Ethyl chrysanthemate. Norchrysanthemic acid methyl ester. trans-Chrysanthemol. cis-Chrysanthemyl alcohol. Trans-chrysanthemal. ((1R,3R)-2,2-dimethyl-3-(2-methylprop-1-en-1-yl)cyclopropyl)methyl acetate. 1,3,3-Trimethylcyclohex-1-ene-4-carboxylic acid. Chrysanthemumic acid 2,4-dimethylbenzyl ester. Cis-3-methyl-4-cyclohexene-1,2-dicarboxylic acid. Phenothrin. trans-carbomethoxy-1,2-methylcyclohex-3-ene. cis-1-carbomethoxy-1,2-dimethylcyclohex-3-ene. cis-1-carbomethoxy-2-tert-butylcyclohex-3-ene. trans-carbomethoxy-2-tert-butylcyclohex-3-ene.

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