Chemical Properties of Precocene I (CAS 17598-02-6)

Precocene I

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InChI
InChI=1S/C12H14O2/c1-12(2)7-6-9-4-5-10(13-3)8-11(9)14-12/h4-8H,1-3H3
InChI Key
CPTJXGLQLVPIGP-UHFFFAOYSA-N
Formula
C12H14O2
SMILES
COc1ccc2c(c1)OC(C)(C)C=C2
Molecular Weight1
190.24
CAS
17598-02-6
Other Names
  • 2H-1-Benzopyran, 7-methoxy-2,2-dimethyl-
  • Demethoxyageratochromene
  • 6-Demethoxyageratochromene
  • 7-Methoxy-2,2-dimethylchromene
  • Precocene 1
  • Pricocene I
  • 2H-1-Benzopyran, 2,2-dimethyl-7-methoxy-
  • 2,2-Dimethyl-7-methoxy-2H-1-benzopyran
  • NSC 318791
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Physical Properties

Property Value Unit Source
Δf 25.31 kJ/mol Joback Calculated Property
Δfgas -201.98 kJ/mol Joback Calculated Property
Δfus 20.22 kJ/mol Joback Calculated Property
Δvap 52.05 kJ/mol Joback Calculated Property
log10WS -3.38 Crippen Calculated Property
logPoct/wat 2.879 Crippen Calculated Property
McVol 152.760 ml/mol McGowan Calculated Property
Pc 2893.62 kPa Joback Calculated Property
Inp [1428.00; 1478.00]   Show Hide
Inp 1440.00 NIST
Inp 1478.00 NIST
Inp 1471.60 NIST
Inp 1464.00 NIST
Inp Outlier 1428.00 NIST
Inp 1463.00 NIST
Inp 1467.00 NIST
Inp 1478.00 NIST
Inp 1471.60 NIST
I [2046.00; 2075.00]   Show Hide
I 2046.00 NIST
I 2075.00 NIST
I 2068.00 NIST
Tboil 570.38 K Joback Calculated Property
Tc 802.38 K Joback Calculated Property
Tfus 364.34 K Joback Calculated Property
Vc 0.572 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [369.74; 450.16] J/mol×K [570.38; 802.38] Show Hide
Cp,gas 369.74 J/mol×K 570.38 Joback Calculated Property
Cp,gas 385.17 J/mol×K 609.05 Joback Calculated Property
Cp,gas 399.60 J/mol×K 647.71 Joback Calculated Property
Cp,gas 413.17 J/mol×K 686.38 Joback Calculated Property
Cp,gas 426.03 J/mol×K 725.05 Joback Calculated Property
Cp,gas 438.31 J/mol×K 763.72 Joback Calculated Property
Cp,gas 450.16 J/mol×K 802.38 Joback Calculated Property

Similar Compounds

7-Hydroxy-2,2-dimethylchromene. 2H-1-Benzopyran, 6,7-dimethoxy-2,2-dimethyl-. 6-vinyl-7-methoxy-2,2-dimethyl-chromene. 2H-1-Benzopyran, 2,2-dimethyl-. (E)-Werneria chromene. Encecalin. Desmethoxyencecalin. eupatoriochromene. 6-(1'-Hydroxyethyl)-2,2-dimethylchromene. 6-(1'-Hydroxyethyl)-7-methoxy-2,2-dimethylchromene. Ethanone, 1-(7-hydroxy-5-methoxy-2,2-dimethyl-2H-1-benzopyran-8-yl)-. trans-2,4-Dimethoxycinnamic acid, tert-butyldimethylsilyl ester. trans-2,4-Dimethoxycinnamic acid, benzyldimethylsilyl ester. N-desmethylacronycine. Acronine.

Find more compounds similar to Precocene I.

Sources

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Outlier This icon means that the value is more than 2 standard deviations away from the property mean.