Chemical Properties of 1,3-Benzodioxole (CAS 274-09-9)

1,3-Benzodioxole

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InChI
InChI=1S/C7H6O2/c1-2-4-7-6(3-1)8-5-9-7/h1-4H,5H2
InChI Key
FTNJQNQLEGKTGD-UHFFFAOYSA-N
Formula
C7H6O2
SMILES
c1ccc2c(c1)OCO2
Molecular Weight1
122.12
CAS
274-09-9
Other Names
  • Benzene, 1,2-(methylenedioxy)-
  • (Methylenedioxy)benzene
  • o-Methylenedioxybenzene
  • Benzene, 1,2-[methylenebis(oxy)]-
  • Benzodioxole
  • 1,2-(Methylenedioxy)benzene
  • 1,3-Dioxaindan
  • 1,3-Dioxindan
  • 3,4-Methylenedioxybenzene
  • 2H-1,3-Benzodioxole
  • NSC 30095
  • 1,3-benzodioxolane
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Physical Properties

Property Value Unit Source
Δcliquid -3428.00 ± 2.00 kJ/mol NIST
Δf 7.06 kJ/mol Joback Calculated Property
Δfgas -133.61 kJ/mol Joback Calculated Property
Δfus 20.56 kJ/mol Joback Calculated Property
Δvap 41.40 kJ/mol NIST
IE [8.00; 8.21] eV Show Hide
IE 8.00 eV NIST
IE 8.21 eV NIST
log10WS -1.68 Crippen Calculated Property
logPoct/wat 1.415 Crippen Calculated Property
McVol 86.610 ml/mol McGowan Calculated Property
Pc 4897.06 kPa Joback Calculated Property
I [1530.00; 1531.00]   Show Hide
I 1530.00 NIST
I 1531.00 NIST
Tboil 445.70 K NIST
Tc 688.03 K Joback Calculated Property
Tfus 282.91 K Joback Calculated Property
Vc 0.320 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [174.58; 228.44] J/mol×K [456.53; 688.03] Show Hide
Cp,gas 174.58 J/mol×K 456.53 Joback Calculated Property
Cp,gas 185.56 J/mol×K 495.11 Joback Calculated Property
Cp,gas 195.66 J/mol×K 533.70 Joback Calculated Property
Cp,gas 204.93 J/mol×K 572.28 Joback Calculated Property
Cp,gas 213.44 J/mol×K 610.86 Joback Calculated Property
Cp,gas 221.26 J/mol×K 649.45 Joback Calculated Property
Cp,gas 228.44 J/mol×K 688.03 Joback Calculated Property
η [0.0005036; 0.0023229] Pa×s [282.91; 456.53] Show Hide
η 0.0023229 Pa×s 282.91 Joback Calculated Property
η 0.0015997 Pa×s 311.85 Joback Calculated Property
η 0.0011737 Pa×s 340.78 Joback Calculated Property
η 0.0009039 Pa×s 369.72 Joback Calculated Property
η 0.0007230 Pa×s 398.66 Joback Calculated Property
η 0.0005961 Pa×s 427.59 Joback Calculated Property
η 0.0005036 Pa×s 456.53 Joback Calculated Property

Pressure Dependent Properties

Property Value Unit Pressure (kPa) Source
Tboilr 344.00 ± 1.00 K 2.70 NIST

Similar Compounds

1,3-Benzodioxol-5-ol. 1-Iodo-3,4-methylenedioxybenzene. 5-Chloro-1,3-benzodioxole. Benzene, 1,2-dimethoxy-. 4-Bromo-1,2-(methylenedioxy)benzene. (R,E)-6-(2-(Benzo[d][1,3]dioxol-5-yl)vinyl)-4-methoxy-5,6-dihydro-2H-pyran-2-one. Bis(2-methoxyphenyl) carbonate. Piperonylonitrile. Phenol, 2-methoxy-. Formic acid, 2-methoxyphenyl ester. 1,2,3-Trimethoxybenzene. 1,3-Benzodioxol-5-amine. 3,4-Methylenedioxyphenyl isothiocyanate. 1,2,4-Trimethoxybenzene. 3,4-(Methylenedioxy)toluene.

Find more compounds similar to 1,3-Benzodioxole.

Sources

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