Chemical Properties of 3-Diethylamino-1-phenylpropyne (CAS 22396-72-1)

3-Diethylamino-1-phenylpropyne

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InChI
InChI=1S/C13H17N/c1-3-14(4-2)12-8-11-13-9-6-5-7-10-13/h5-7,9-10H,3-4,12H2,1-2H3
InChI Key
NGTMXVYXKKHDPO-UHFFFAOYSA-N
Formula
C13H17N
SMILES
CCN(CC)CC#Cc1ccccc1
Molecular Weight1
187.28
CAS
22396-72-1
Other Names
  • 2-Propynylamine, N,N-diethyl-3-phenyl-
  • N,N-Diethyl-3-phenyl-2-propynylamine
Sources

Physical Properties

Property Value Unit Source
Δf 484.57 kJ/mol Joback Calculated Property
Δfgas 264.71 kJ/mol Joback Calculated Property
Δfus 29.61 kJ/mol Joback Calculated Property
Δvap 51.00 kJ/mol Joback Calculated Property
logPoct/wat 2.38 Crippen Calculated Property
Pc 2558.51 kPa Joback Calculated Property
Tboil 418.50 ± 0.50 K NIST
Tc 763.78 K Joback Calculated Property
Tfus 401.26 K Joback Calculated Property
Vc 0.64 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 393.74 J/mol×K 544.96 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
=CH- (ring) 5
>N- 1
#C- 2
=C< (ring) 1
-CH2- 3
-CH3 2

Similar Compounds

Phenylpropiolamide. Benzene, 1-propynyl-. 3-Phenyl-2-propyn-1-ol. Benzene, 1-methyl-4-(1-propynyl)-. Benzene, 1-butynyl-. Phenylpropargyl aldehyde. Benzene, 1,1'-(1,3-butadiyne-1,4-diyl)bis-. 1-Phenyl-1-pentyne. Benzene, 1-hexynyl-. Phenylpropiolic acid. 4-Phenyl-3-butyn-2-one. 1-Phenyl-1-heptyne. 1-Phenyl-1-octyne. 1-Phenyl-1-nonyne. Benzene, 1,1'-(1-buten-3-yne-1,4-diyl)bis-.

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