Chemical Properties of Benzeneacetonitrile, 4-methoxy- (CAS 104-47-2)

Benzeneacetonitrile, 4-methoxy-

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InChI
InChI=1S/C9H9NO/c1-11-9-4-2-8(3-5-9)6-7-10/h2-5H,6H2,1H3
InChI Key
PACGLQCRGWFBJH-UHFFFAOYSA-N
Formula
C9H9NO
SMILES
COc1ccc(CC#N)cc1
Molecular Weight1
147.17
CAS
104-47-2
Other Names
  • Acetonitrile, (p-methoxyphenyl)-
  • p-Methoxybenzeneacetonitrile
  • p-Methoxybenzyl cyanide
  • p-Methoxyphenylacetonitrile
  • 4-Methoxyphenylacetonitrile
  • 4-Methoxyphenylacetic acid nitrile
  • p-Anisylacetonitrile
  • Anisylacetonitrile
  • NSC 96
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Physical Properties

Property Value Unit Source
Δf 155.86 kJ/mol Joback Calculated Property
Δfgas 28.63 kJ/mol Joback Calculated Property
Δfus 15.41 kJ/mol Joback Calculated Property
Δvap 51.45 kJ/mol Joback Calculated Property
IE 8.77 ± 0.05 eV NIST
log10WS -2.26 Crippen Calculated Property
logPoct/wat 1.761 Crippen Calculated Property
McVol 121.160 ml/mol McGowan Calculated Property
Pc 3059.17 kPa Joback Calculated Property
Inp [1336.00; 1370.00]   Show Hide
Inp 1370.00 NIST
Inp 1336.00 NIST
I 2305.00 NIST
Tboil 559.70 K NIST
Tc 787.14 K Joback Calculated Property
Tfus 317.35 K Joback Calculated Property
Vc 0.475 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [265.49; 322.45] J/mol×K [561.48; 787.14] Show Hide
Cp,gas 265.49 J/mol×K 561.48 Joback Calculated Property
Cp,gas 276.53 J/mol×K 599.09 Joback Calculated Property
Cp,gas 286.94 J/mol×K 636.70 Joback Calculated Property
Cp,gas 296.73 J/mol×K 674.31 Joback Calculated Property
Cp,gas 305.90 J/mol×K 711.92 Joback Calculated Property
Cp,gas 314.47 J/mol×K 749.53 Joback Calculated Property
Cp,gas 322.45 J/mol×K 787.14 Joback Calculated Property

Similar Compounds

4-(Trifluoromethoxy)phenylacetonitrile. Benzene, 1-(2,2,2-trifluoroethyl)-4-methoxy. Benzene, 1-ethyl-4-methoxy-. Benzeneacetonitrile, 4-hydroxy-. (3-Methoxyphenyl)acetonitrile. Benzeneacetonitrile, 3,4-dimethoxy-. 4-Benzyloxyphenylacetonitrile. 4-Methoxyphenylacetaldehyde. Benzene, 1-(2-bromoethyl)-4-methoxy-. 4-Methoxy-3-methylphenylacetonitrile. 4-Phenoxyphenylacetonitrile. 3-Bromo-4-methoxyphenylacetonitrile. 3-Fluoro-4-methoxyphenylacetonitrile. Estragole. «beta»(p-Methoxyphenyl)propionitrile.

Find more compounds similar to Benzeneacetonitrile, 4-methoxy-.

Sources

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