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
  • 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
  • Ethanamine, 2-phenyl-
  • Ethylamine, 2-phenyl-
  • NSC 10811
  • Phenethylamine
  • Phenethylamine, «beta»
  • Phenylethylamine
  • «beta»-Aminoethylbenzene
  • «beta»-Phenethylamine
  • «beta»-Phenylethylamine
Sources

Physical Properties

Property Value Unit Source
PAff 936.20 kJ/mol NIST
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 eV NIST
IE 8.99 ± 0.20 eV NIST
logPoct/wat 1.188 Crippen Calculated Property
Pc 3916.03 kPa Joback Calculated Property
Tboil 470.70 K NIST
Tc 704.67 K Joback Calculated Property
Tfus 289.60 K Joback Calculated Property
Vc 0.405 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 228.62 J/mol×K 481.65 Joback Calculated Property
Cp,liquid 239.24 J/mol×K 298.15 NIST
ΔvapH 55.70 ± 0.20 kJ/mol 314.0 NIST

Molecular Descriptors

Joback and Reid Groups
=C< (ring) 1
-CH2- 2
=CH- (ring) 5
-NH2 1

Similar Compounds

2-Phenylethylammonium bromide. 2-Phenylethylammonium chloride. 2-Phenylethylammonium nitrate. Benzeneethanamine, N-methyl-. 2-(p-Tolyl)ethylamine. 4-Ethylphenethylamine. Phenelzine. N-Ethyl-2-phenethylamine. Formamide, n-phenethyl-. Benzeneethanamine, n-(2-phenylethyl)-. Benzeneethanamine, N,N-dimethyl-. Ethylbenzene. 1-Phenylethyl radical. (2-Isocyanatoethyl)benzene. Benzene, (2-isothiocyanatoethyl)-.

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