Chemical Properties of Benzylamine (CAS 100-46-9)

Benzylamine

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InChI
InChI=1S/C7H9N/c8-6-7-4-2-1-3-5-7/h1-5H,6,8H2
InChI Key
WGQKYBSKWIADBV-UHFFFAOYSA-N
Formula
C7H9N
SMILES
NCc1ccccc1
Molecular Weight1
107.15
CAS
100-46-9
Other Names
  • (Aminomethyl)benzene
  • (Phenylmethyl)amine
  • .alpha.-aminotoluene
  • ALPHA-AMINOTOLUENE
  • Benzenemethanamine
  • MONOBENZYLAMINE
  • N-Benzylamine
  • NSC 8046
  • Sumine 2005
  • aminomethylbenzene
  • benzene, aminomethyl-
  • «alpha»-Aminotoluene
  • «omega»-Aminotoluene
  • «alpha»-Aminotoluene
  • «omega»-Aminotoluene
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Physical Properties

Property Value Unit Source
PAff [913.30; 924.00] kJ/mol Show Hide
PAff 913.30 kJ/mol NIST
PAff 922.70 ± 7.80 kJ/mol NIST
PAff 924.00 ± 4.00 kJ/mol NIST
BasG 879.40 kJ/mol NIST
Δcliquid [-4075.00; -4058.00] kJ/mol Show Hide
Δcliquid -4075.00 ± 1.70 kJ/mol NIST
Δcliquid -4058.00 kJ/mol NIST
SProt -3.00 ± 10.00 J/mol×K NIST
Δf 186.92 kJ/mol Joback Calculated Property
Δfgas [56.60; 87.80] kJ/mol Show Hide
Δfgas 87.80 ± 2.70 kJ/mol NIST
Δfgas 56.60 kJ/mol NIST
Δfliquid [3.00; 34.20] kJ/mol Show Hide
Δfliquid 34.20 ± 1.70 kJ/mol NIST
Δfliquid 3.00 kJ/mol NIST
Δfus 13.12 kJ/mol Joback Calculated Property
Δvap [53.60; 60.16] kJ/mol Show Hide
Δvap 60.16 kJ/mol NIST
Δvap 54.60 ± 0.30 kJ/mol NIST
Δvap 54.00 ± 2.00 kJ/mol NIST
Δvap 53.60 kJ/mol NIST
IE [8.49; 9.46] eV Show Hide
IE 8.49 ± 0.06 eV NIST
IE 8.80 eV NIST
IE 8.73 eV NIST
IE 8.64 ± 0.05 eV NIST
IE 9.46 eV NIST
IE 9.10 ± 0.01 eV NIST
log10WS -1.53 Aq. Sol...
logPoct/wat 1.145 Crippen Calculated Property
McVol 95.710 ml/mol McGowan Calculated Property
Pc 4432.62 kPa Joback Calculated Property
Inp [983.90; 1035.00]   Show Hide
Inp 1035.00 NIST
Inp 1035.00 NIST
Inp 983.90 NIST
Inp 1019.20 NIST
Inp 994.00 NIST
Inp 995.00 NIST
Inp 1019.20 NIST
Inp 983.90 NIST
I [1307.00; 1307.00]   Show Hide
I 1307.00 NIST
I 1307.00 NIST
Tboil [358.00; 458.15] K Show Hide
Tboil 456.70 K NIST
Tboil 457.00 K NIST
Tboil 458.00 K NIST
Tboil Outlier 358.00 ± 2.00 K NIST
Tboil 458.15 ± 0.30 K NIST
Tboil 457.65 ± 0.50 K NIST
Tc 685.40 K Joback Calculated Property
Tfus 260.65 K Aq. Sol...
Vc 0.348 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [187.78; 248.07] J/mol×K [458.77; 685.40] Show Hide
Cp,gas 187.78 J/mol×K 458.77 Joback Calculated Property
Cp,gas 199.64 J/mol×K 496.54 Joback Calculated Property
Cp,gas 210.72 J/mol×K 534.31 Joback Calculated Property
Cp,gas 221.07 J/mol×K 572.08 Joback Calculated Property
Cp,gas 230.72 J/mol×K 609.85 Joback Calculated Property
Cp,gas 239.71 J/mol×K 647.63 Joback Calculated Property
Cp,gas 248.07 J/mol×K 685.40 Joback Calculated Property
Cp,liquid 207.18 J/mol×K 298.15 NIST
ΔvapH [51.80; 52.70] kJ/mol [327.50; 380.00] Show Hide
ΔvapH 52.70 ± 0.30 kJ/mol 327.50 NIST
ΔvapH 51.80 kJ/mol 380.00 NIST
Pvap [0.01; 4.07] kPa [275.50; 362.67] Show Hide
Pvap 0.01 kPa 275.50 The Vap...
Pvap 0.02 kPa 276.70 The Vap...
Pvap 0.01 kPa 276.70 The Vap...
Pvap 0.02 kPa 278.60 The Vap...
Pvap 0.02 kPa 279.60 The Vap...
Pvap 0.02 kPa 279.60 The Vap...
Pvap 0.02 kPa 281.50 The Vap...
Pvap 0.03 kPa 282.30 The Vap...
Pvap 0.03 kPa 282.30 The Vap...
Pvap 0.03 kPa 284.50 The Vap...
Pvap 0.03 kPa 285.70 The Vap...
Pvap 0.03 kPa 285.70 The Vap...
Pvap 0.04 kPa 287.60 The Vap...
Pvap 0.04 kPa 288.00 The Vap...
Pvap 0.04 kPa 288.00 The Vap...
Pvap 0.05 kPa 290.50 The Vap...
Pvap 0.05 kPa 291.60 The Vap...
Pvap 0.05 kPa 291.60 The Vap...
Pvap 0.06 kPa 292.74 Experim...
Pvap 0.06 kPa 293.50 The Vap...
Pvap 0.06 kPa 294.20 The Vap...
Pvap 0.06 kPa 294.20 The Vap...
Pvap 0.08 kPa 296.50 The Vap...
Pvap 0.08 kPa 297.70 The Vap...
Pvap 0.08 kPa 297.70 The Vap...
Pvap 0.09 kPa 298.40 The Vap...
Pvap 0.10 kPa 300.30 The Vap...
Pvap 0.10 kPa 300.30 The Vap...
Pvap 0.11 kPa 301.30 The Vap...
Pvap 0.13 kPa 302.68 Experim...
Pvap 0.13 kPa 303.30 The Vap...
Pvap 0.13 kPa 303.40 The Vap...
Pvap 0.13 kPa 303.40 The Vap...
Pvap 0.13 kPa 303.50 The Vap...
Pvap 0.14 kPa 304.30 The Vap...
Pvap 0.15 kPa 306.10 The Vap...
Pvap 0.15 kPa 306.30 The Vap...
Pvap 0.17 kPa 307.40 The Vap...
Pvap 0.18 kPa 308.30 The Vap...
Pvap 0.18 kPa 308.40 The Vap...
Pvap 0.19 kPa 309.40 The Vap...
Pvap 0.20 kPa 309.50 The Vap...
Pvap 0.21 kPa 310.30 The Vap...
Pvap 0.23 kPa 312.20 The Vap...
Pvap 0.23 kPa 312.30 The Vap...
Pvap 0.23 kPa 312.30 The Vap...
Pvap 0.26 kPa 312.69 Experim...
Pvap 0.25 kPa 313.40 The Vap...
Pvap 0.30 kPa 315.60 The Vap...
Pvap 0.49 kPa 322.67 Experim...
Pvap 0.88 kPa 332.70 Experim...
Pvap 1.52 kPa 342.68 Experim...
Pvap 2.51 kPa 352.67 Experim...
Pvap 4.07 kPa 362.67 Experim...
ρl [849.30; 983.66] kg/m3 [293.15; 443.15] Show Hide
ρl 983.40 kg/m3 293.15 Measure...
ρl 983.00 kg/m3 293.15 Volumet...
ρl 983.66 kg/m3 293.15 Measure...
ρl 979.35 kg/m3 298.15 Measure...
ρl 978.34 kg/m3 298.15 Thermod...
ρl 978.00 kg/m3 298.15 Volumet...
ρl 978.34 kg/m3 298.15 THERMOD...
ρl 978.34 kg/m3 298.15 Thermod...
ρl 978.90 kg/m3 298.15 Measure...
ρl 974.40 kg/m3 303.15 Measure...
ρl 974.00 kg/m3 303.15 Volumet...
ρl 975.60 kg/m3 303.15 Unravel...
ρl 975.01 kg/m3 303.15 Measure...
ρl 970.67 kg/m3 308.15 Measure...
ρl 970.00 kg/m3 308.15 Measure...
ρl 966.33 kg/m3 313.15 Measure...
ρl 965.00 kg/m3 313.15 Volumet...
ρl 965.70 kg/m3 313.15 Measure...
ρl 961.30 kg/m3 318.15 Measure...
ρl 961.98 kg/m3 318.15 Measure...
ρl 956.90 kg/m3 323.15 Measure...
ρl 957.00 kg/m3 323.15 Volumet...
ρl 957.63 kg/m3 323.15 Measure...
ρl 953.27 kg/m3 328.15 Measure...
ρl 952.50 kg/m3 328.15 Measure...
ρl 948.20 kg/m3 333.15 Measure...
ρl 948.90 kg/m3 333.15 Measure...
ρl 944.53 kg/m3 338.15 Measure...
ρl 943.70 kg/m3 338.15 Measure...
ρl 940.14 kg/m3 343.15 Measure...
ρl 939.40 kg/m3 343.15 Measure...
ρl 935.00 kg/m3 348.15 Measure...
ρl 930.60 kg/m3 353.15 Measure...
ρl 926.20 kg/m3 358.15 Measure...
ρl 921.80 kg/m3 363.15 Measure...
ρl 917.30 kg/m3 368.15 Measure...
ρl 912.90 kg/m3 373.15 Measure...
ρl 908.50 kg/m3 378.15 Measure...
ρl 904.00 kg/m3 383.15 Measure...
ρl 899.70 kg/m3 388.15 Measure...
ρl 895.20 kg/m3 393.15 Measure...
ρl 890.60 kg/m3 398.15 Measure...
ρl 886.20 kg/m3 403.15 Measure...
ρl 881.60 kg/m3 408.15 Measure...
ρl 877.10 kg/m3 413.15 Measure...
ρl 872.50 kg/m3 418.15 Measure...
ρl 867.90 kg/m3 423.15 Measure...
ρl 863.30 kg/m3 428.15 Measure...
ρl 858.70 kg/m3 433.15 Measure...
ρl 854.00 kg/m3 438.15 Measure...
ρl 849.30 kg/m3 443.15 Measure...
γ [0.04; 0.04] N/m [283.15; 323.15] Show Hide
γ 0.04 N/m 283.15 Surface...
γ 0.04 N/m 293.15 Surface...
γ 0.04 N/m 303.15 Surface...
γ 0.04 N/m 313.15 Surface...
γ 0.04 N/m 323.15 Surface...

Pressure Dependent Properties

Property Value Unit Pressure (kPa) Source
Tboilr [363.00; 363.20] K [1.60; 1.60] Show Hide
Tboilr 363.20 K 1.60 NIST
Tboilr 363.00 K 1.60 NIST

Correlations

Property Value Unit Temperature (K) Source
Pvap [1.33; 202.64] kPa [339.90; 486.90] The Yaw... Show Hide
Equationln(Pvp) = A + B/(T + C)
Coefficient A1.49879e+01
Coefficient B-4.16213e+03
Coefficient C-5.67710e+01
Temperature range, min.339.90
Temperature range, max.486.90
Pvap 1.33 kPa 339.90 Calculated Property
Pvap 2.97 kPa 356.23 Calculated Property
Pvap 6.10 kPa 372.57 Calculated Property
Pvap 11.66 kPa 388.90 Calculated Property
Pvap 20.98 kPa 405.23 Calculated Property
Pvap 35.82 kPa 421.57 Calculated Property
Pvap 58.40 kPa 437.90 Calculated Property
Pvap 91.48 kPa 454.23 Calculated Property
Pvap 138.31 kPa 470.57 Calculated Property
Pvap 202.64 kPa 486.90 Calculated Property
Pvap [7.50e-05; 4238.78] kPa [227.15; 683.50] KDB Vap... Show Hide
Equationln(Pvp) = A + B/T + C*ln(T) + D*T^2
Coefficient A7.85699e+01
Coefficient B-8.96094e+03
Coefficient C-8.99328e+00
Coefficient D3.41134e-06
Temperature range, min.227.15
Temperature range, max.683.50
Pvap 7.50e-05 kPa 227.15 Calculated Property
Pvap 0.02 kPa 277.86 Calculated Property
Pvap 0.64 kPa 328.56 Calculated Property
Pvap 7.61 kPa 379.27 Calculated Property
Pvap 45.93 kPa 429.97 Calculated Property
Pvap 177.77 kPa 480.68 Calculated Property
Pvap 509.05 kPa 531.38 Calculated Property
Pvap 1181.43 kPa 582.09 Calculated Property
Pvap 2361.45 kPa 632.79 Calculated Property
Pvap 4238.78 kPa 683.50 Calculated Property

Similar Compounds

p-Xylylenediamine. Benzenemethanamine, 4-methyl-. 1,3-Benzenedimethanamine. Benzenemethanamine, 3-methyl-. Benzenemethanamine, 4-chloro-. p-Bromobenzylamine. Benzenemethanamine, 4-fluoro-. Benzenemethanamine, 3-chloro-. Benzene, (isocyanomethyl)-. Benzenemethanamine, 2-methyl-. Benzenemethanamine, 3-fluoro-. 1-Naphthalenemethanamine. N,N-Difluorobenzylamine. Benzenemethanamine, 3,4-dimethyl-. Benzenemethanamine, N-methyl-.

Find more compounds similar to Benzylamine.

Mixtures

Sources

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