Chemical Properties of 4-N,N-Bis(2-chloroethyl)amino-2-tolualdehyde (CAS 26459-95-0)

4-N,N-Bis(2-chloroethyl)amino-2-tolualdehyde

InChI
InChI=1S/C12H15Cl2NO/c1-10-8-12(3-2-11(10)9-16)15(6-4-13)7-5-14/h2-3,8-9H,4-7H2,1H3
InChI Key
ZQIAXDULHBLZJE-UHFFFAOYSA-N
Formula
C12H15Cl2NO
SMILES
Cc1cc(N(CCCl)CCCl)ccc1C=O
Molecular Weight1
260.16
CAS
26459-95-0
Other Names
  • o-Tolualdehyde, 4-(bis(2-chloroethyl)amino)-
  • Benzaldehyde, 4-[bis(2-chloroethyl)amino]-2-methyl-
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Physical Properties

Property Value Unit Source
ω 0.6831 Relay (1.0) Calculated Property
ΔfG° 130.71 kJ/mol Joback Calculated Property
ΔfH°gas -160.56 kJ/mol Relay (1.0) Calculated Property
ΔfusH° 33.80 kJ/mol Joback Calculated Property
ΔvapH° 85.63 kJ/mol Relay (1.0) Calculated Property
IE 8.10 eV Relay (1.0) Calculated Property
log10WS -4.12 Relay (1.0) Calculated Property
logPoct/wat 3.092 Crippen Calculated Property
McVol 192.210 ml/mol McGowan Calculated Property
Pc 2331.52 kPa Joback Calculated Property
Tboil 610.57 K Relay (1.0) Calculated Property
Tc 862.34 K Relay (1.0) Calculated Property
Tfus 325.83 K Relay (1.0) Calculated Property
Vc 0.653 m3/kmol Relay (1.0) Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [459.44; 526.92] J/mol×K [646.56; 856.87] Show Hide
Cp,gas 459.44 J/mol×K 646.56 Joback Calculated Property
Cp,gas 472.66 J/mol×K 681.61 Joback Calculated Property
Cp,gas 485.04 J/mol×K 716.66 Joback Calculated Property
Cp,gas 496.61 J/mol×K 751.72 Joback Calculated Property
Cp,gas 507.42 J/mol×K 786.77 Joback Calculated Property
Cp,gas 517.51 J/mol×K 821.82 Joback Calculated Property
Cp,gas 526.92 J/mol×K 856.87 Joback Calculated Property

Similar Compounds

4-Bis(2-chloroethyl)aminobenzaldehyde. p-([2-Chloroethyl]ethylamino)benzaldehyde. Chloroacetamide, N-ethyl-N-(3-methylphenyl)-. 2-(N-Ethyl-N-tolylamino)ethanol, trifluoroacetate. 2-(N-Ethyl-N-tolylamino)ethanol, pentafluoropropionate. 4-Dimethylamino-o-tolualdehyde. Dichloroacetamide, N-ethyl-N-(3-methylphenyl)-. 2-(N-Ethyl-N-toluidino)ethanol, acetate. 2-(Ethyl(m-tolyl)amino)ethyl (E)-2-methylbut-2-enoate. 2-(N-Ethyl-N-tolylamino)ethanol, heptafluorobutyrate. p-N,N-Bis(2-chloroethyl)aminobenzoic acid. N-(m-Tolyl)-diethanolamine. Ethanol, 2-[ethyl(3-methylphenyl)amino]-. Propanamide, N-ethyl-N-(3-methylphenyl)-2-chloro-. 2-(N-Ethyl-N-toluidino)ethanol, methyl ether.

Find more compounds similar to 4-N,N-Bis(2-chloroethyl)amino-2-tolualdehyde.

Sources

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