Chemical Properties of Phenol, 3,5-dimethyl-, methylcarbamate

Phenol, 3,5-dimethyl-, methylcarbamate

InChI
InChI=1S/C10H13NO2/c1-7-4-8(2)6-9(5-7)13-10(12)11-3/h4-6H,1-3H3,(H,11,12)
InChI Key
CVQODEWAPZVVBU-UHFFFAOYSA-N
Formula
C10H13NO2
SMILES
CNC(=O)Oc1cc(C)cc(C)c1
Molecular Weight1
179.22
Other Names
  • 3,5-Dimethylphenyl N-methylcarbamate
  • 3,5-Dimethylphenyl methylcarbamate
  • 3,5-Xmc
  • 3,5-Xylenol, methylcarbamate
  • 3,5-Xylenyl N-methylcarbamate
  • 3,5-Xylyl N-methylcarbamate
  • 3,5-Xylyl methylcarbamate
  • 3,5-Xylylester kyseliny methylkarbaminove
  • Carbamic acid, methyl-, 3,5-xylyl ester
  • Cosban
  • DRC 3340
  • H-69
  • Macbal
  • Maqbarl
  • Methylcarbamic acid 3,5-xylyl ester
  • NSC 35375
  • Phenol, 3,5-dimethyl-, 1-(N-methylcarbamate)
  • S 1041
  • XMC
  • XMC (Pesticide)
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Physical Properties

Property Value Unit Source
ΔfusH° 24.39 kJ/mol Joback Calculated Property
log10WS [-2.58; -2.58]   Show Hide
log10WS -2.58 Aq. Solubility Prediction
log10WS -2.58 Estimated Solubility
logPoct/wat 2.022 Crippen Calculated Property
McVol 145.420 ml/mol McGowan Calculated Property
Inp [1563.00; 1564.00]   Show Hide
Inp 1564.00 NIST
Inp 1563.00 NIST
Inp 1564.00 NIST
Ip 2173.00 NIST
Tboil 534.46 K Relay (1.0) Calculated Property
Tfus 372.15 K Jean-Claude Bradley Open Melting Point Dataset (2014, CC0) Compiled value

Cheméo can also estimate Critical Temperature, Critical Pressure, Critical Volume, Enthalpy of formation at standard conditions, Enthalpy of vaporization at standard conditions, Standard Gibbs free energy of formation, Acentric Factor, Ionization energy for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.

Correlations

Property Value Unit Temperature (K) Source
Cp,gas [197.99; 455.63] J/mol×K [273.00; 1000.00] Joback Predicted correlation Show Hide
EquationY = A + B·T + C·T² + D·T³ + E·T⁴
Y is Cp,gas in J/mol×K, T in K
Coefficient A1.26900e+01
Coefficient B7.77360e-01
Coefficient C-3.71320e-04
Coefficient D3.69000e-08
Coefficient E0.00000e+00
Temperature range, min.273.00
Temperature range, max.1000.00
Cp,gas 197.99 J/mol×K 273.00 Calculated Property
Cp,gas 242.86 J/mol×K 353.78 Calculated Property
Cp,gas 283.40 J/mol×K 434.56 Calculated Property
Cp,gas 319.73 J/mol×K 515.33 Calculated Property
Cp,gas 351.95 J/mol×K 596.11 Calculated Property
Cp,gas 380.19 J/mol×K 676.89 Calculated Property
Cp,gas 404.56 J/mol×K 757.67 Calculated Property
Cp,gas 425.18 J/mol×K 838.44 Calculated Property
Cp,gas 442.16 J/mol×K 919.22 Calculated Property
Cp,gas 455.63 J/mol×K 1000.00 Calculated Property

Similar Compounds

Carbamic acid, methyl-, 3-methylphenyl ester. Phenol, 3,4,5-trimethyl-, methylcarbamate. Phenol, 2,3,5-trimethyl-, methylcarbamate. MPMC. Phenol, 3-methyl-5-(1-methylethyl)-, methylcarbamate. Methiocarb. XMC, TFA. 2-Methylphenyl-n-methylcarbamate. Phenol, 4-(dimethylamino)-3,5-dimethyl-, methylcarbamate (ester). 3,5-Dimethylphenyl 2,2,2-trifluoroacetate. Trichloroacetic acid, 3,5-dimethylphenyl ester. Phenol, 3,5-dimethyl-, acetate. butacarb. Mesurol sulfoxide. 3,5-DIMETHYLANISOLE.

Find more compounds similar to Phenol, 3,5-dimethyl-, methylcarbamate.

Sources

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Calculated This icon marks a calculated value or equation: a prediction, not a measurement.
Compiled This icon marks a compiled value or equation: taken from a data compilation such as ChemSep, not from an original measurement report.
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