Chemical Properties of Benzeneethanamine (CAS 64-04-0)

Benzeneethanamine

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InChI
InChI=1S/C8H11N/c9-7-6-8-4-2-1-3-5-8/h1-5H,6-7,9H2
InChI Key
BHHGXPLMPWCGHP-UHFFFAOYSA-N
Formula
C8H11N
SMILES
NCCc1ccccc1
Molecular Weight1
121.18
CAS
64-04-0
Other Names
  • (2-Aminoethyl)benzene
  • (2-phenylethyl)amine
  • .beta.-phenylethylamine
  • 1-Amino-2-phenylethane
  • 1-Phenyl-2-amino-athan
  • 1-Phenyl-2-aminoethane
  • 2-Amino-1-phenylethane
  • 2-Amino-fenylethan
  • 2-Fenylethylamin
  • 2-Phenethylamine
  • 2-Phenylethylamine
  • 2-phenylethanamine
  • Ethanamine, 2-phenyl-
  • Ethylamine, 2-phenyl-
  • NSC 10811
  • Phenethylamine
  • Phenethylamine, «beta»
  • Phenethylamine, «beta»
  • Phenylethylamine
  • «beta»-Aminoethylbenzene
  • «beta»-Phenethylamine
  • «beta»-Phenylethylamine
  • «beta»-Aminoethylbenzene
  • «beta»-Phenethylamine
  • «beta»-Phenylethylamine

Physical Properties

Property Value Unit Source
PAff 936.20 kJ/mol NIST
BasG [900.00; 902.30] kJ/mol Show Hide
BasG 902.30 kJ/mol NIST
BasG 900.00 ± 4.00 kJ/mol NIST
Δf 195.34 kJ/mol Joback Calculated Property
Δfgas 61.87 kJ/mol Joback Calculated Property
Δfus 15.71 kJ/mol Joback Calculated Property
Δvap 56.80 ± 0.20 kJ/mol NIST
IE [8.50; 8.99] eV Show Hide
IE 8.50 eV NIST
IE 8.99 ± 0.20 eV NIST
log10WS -1.71 Crippen Calculated Property
logPoct/wat 1.188 Crippen Calculated Property
McVol 109.800 ml/mol McGowan Calculated Property
Pc 3916.03 kPa Joback Calculated Property
Inp [1069.90; 1133.00]   Show Hide
Inp 1103.00 NIST
Inp 1125.00 NIST
Inp 1100.00 NIST
Inp 1120.00 NIST
Inp Outlier 1069.90 NIST
Inp 1098.00 NIST
Inp 1115.00 NIST
Inp 1133.00 NIST
Inp 1120.00 NIST
Inp 1100.70 NIST
Inp 1115.00 NIST
Inp 1079.00 NIST
Inp 1133.00 NIST
Inp 1111.00 NIST
Inp 1125.00 NIST
I [1605.00; 1638.00]   Show Hide
I 1605.00 NIST
I 1622.00 NIST
I 1638.00 NIST
Tboil 470.70 K NIST
Tc 704.67 K Joback Calculated Property
Tfus 289.60 K Joback Calculated Property
Vc 0.405 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [228.62; 295.29] J/mol×K [481.65; 704.67] Show Hide
Cp,gas 228.62 J/mol×K 481.65 Joback Calculated Property
Cp,gas 241.67 J/mol×K 518.82 Joback Calculated Property
Cp,gas 253.89 J/mol×K 555.99 Joback Calculated Property
Cp,gas 265.33 J/mol×K 593.16 Joback Calculated Property
Cp,gas 276.02 J/mol×K 630.33 Joback Calculated Property
Cp,gas 285.99 J/mol×K 667.50 Joback Calculated Property
Cp,gas 295.29 J/mol×K 704.67 Joback Calculated Property
Cp,liquid 239.24 J/mol×K 298.15 NIST
ΔvapH 55.70 ± 0.20 kJ/mol 314.00 NIST
Pvap [5.57e-03; 1.33] kPa [273.26; 351.79] Show Hide
Pvap 5.57e-03 kPa 273.26 Experim...
Pvap 0.01 kPa 283.18 Experim...
Pvap 0.02 kPa 285.20 The Vap...
Pvap 0.02 kPa 287.40 The Vap...
Pvap 0.02 kPa 288.20 The Vap...
Pvap 0.02 kPa 288.20 The Vap...
Pvap 0.02 kPa 290.10 The Vap...
Pvap 0.03 kPa 293.10 The Vap...
Pvap 0.03 kPa 293.12 Experim...
Pvap 0.03 kPa 293.20 The Vap...
Pvap 0.05 kPa 298.20 The Vap...
Pvap 0.04 kPa 298.20 The Vap...
Pvap 0.04 kPa 298.30 The Vap...
Pvap 0.05 kPa 300.10 The Vap...
Pvap 0.06 kPa 302.00 The Vap...
Pvap 0.07 kPa 303.06 Experim...
Pvap 0.07 kPa 303.20 The Vap...
Pvap 0.06 kPa 303.30 The Vap...
Pvap 0.06 kPa 303.30 The Vap...
Pvap 0.07 kPa 304.20 The Vap...
Pvap 0.07 kPa 305.10 The Vap...
Pvap 0.08 kPa 305.10 The Vap...
Pvap 0.08 kPa 306.40 The Vap...
Pvap 0.09 kPa 308.20 The Vap...
Pvap 0.09 kPa 308.20 The Vap...
Pvap 0.11 kPa 310.40 The Vap...
Pvap 0.12 kPa 311.20 The Vap...
Pvap 0.13 kPa 313.07 Experim...
Pvap 0.13 kPa 313.20 The Vap...
Pvap 0.13 kPa 313.40 The Vap...
Pvap 0.14 kPa 314.20 The Vap...
Pvap 0.18 kPa 317.20 The Vap...
Pvap 0.19 kPa 318.20 The Vap...
Pvap 0.19 kPa 318.40 The Vap...
Pvap 0.22 kPa 320.20 The Vap...
Pvap 0.26 kPa 323.06 Experim...
Pvap 0.27 kPa 323.20 The Vap...
Pvap 0.48 kPa 333.11 Experim...
Pvap 0.84 kPa 343.08 Experim...
Pvap 1.33 kPa 351.79 Experim...

Correlations

Property Value Unit Temperature (K) Source
Pvap [1.33; 202.66] kPa [350.02; 500.47] The Yaw... Show Hide
Equationln(Pvp) = A + B/(T + C)
Coefficient A1.45957e+01
Coefficient B-3.97808e+03
Coefficient C-7.19910e+01
Temperature range, min.350.02
Temperature range, max.500.47
Pvap 1.33 kPa 350.02 Calculated Property
Pvap 3.00 kPa 366.74 Calculated Property
Pvap 6.19 kPa 383.45 Calculated Property
Pvap 11.87 kPa 400.17 Calculated Property
Pvap 21.36 kPa 416.89 Calculated Property
Pvap 36.41 kPa 433.60 Calculated Property
Pvap 59.20 kPa 450.32 Calculated Property
Pvap 92.37 kPa 467.04 Calculated Property
Pvap 139.02 kPa 483.75 Calculated Property
Pvap 202.66 kPa 500.47 Calculated Property

Similar Compounds

2-(p-Tolyl)ethylamine. 4-Ethylphenethylamine. Phenelzine. Benzeneethanamine, N-methyl-. 2-(3-Chlorophenyl)ethylamine. Phenol, 4-(2-aminoethyl)-. Benzene, (2-isothiocyanatoethyl)-. (2-Isocyanatoethyl)benzene. 2-(4-Aminophenyl)ethylamine. Benzeneethanamine, 4-methoxy-. Formamide, N-(2-phenylethyl)-. 1-Nitro-2-phenylethane. Benzeneethanamine, N-(2-phenylethyl)-. 4-Phenoxyphenethylamine. N-Ethyl-2-phenethylamine.

Find more compounds similar to Benzeneethanamine.

Sources

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

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