Chemical Properties of 3-(Diethylamino)propyl isothiocyanate (CAS 2626-52-0)

3-(Diethylamino)propyl isothiocyanate

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InChI
InChI=1S/C8H16N2S/c1-3-10(4-2)7-5-6-9-8-11/h3-7H2,1-2H3
InChI Key
QPBVKSLJBRCKIF-UHFFFAOYSA-N
Formula
C8H16N2S
SMILES
CCN(CC)CCCN=C=S
Molecular Weight1
172.29
CAS
2626-52-0
Sources

Physical Properties

Property Value Unit Source
Δfgas 143.15 kJ/mol Joback Calculated Property
Δvap 45.89 kJ/mol Joback Calculated Property
logPoct/wat 1.82 Crippen Calculated Property
Pc 2587.22 kPa Joback Calculated Property
Tboil 540.83 K Joback Calculated Property
Tc 745.91 K Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
=C= 1
-N= 1
-CH2- 5
-S- 1
-CH3 2
>N- 1

Similar Compounds

3-(Dimethylamino)propyl isothiocyanate. 1,3-Propanediamine, N,N-diethyl-. 3-Morpholinopropyl isothiocyanate. N,N,N',N'-Tetraethyl-1,3-propanediamine. 1,3-Propanediamine, N-(3-aminopropyl)-N-methyl-. 1,3-Bis(triethylammonium)propane dibromide. Formamide, N-[3-(dimethylamino)propyl]-. 1,3-Propanediamine, N,N-dibutyl-. N,n',n''-trimethyldiitrimethylenetriamine. N,N-Bis[(hydroxyethyl)trimethylene]diamine. 1-Propanamine, N,N-diethyl-. Di-n-propylethylamine. 1,3-Propane diisothiocyanate. 1-Propanamine, N,N-dipropyl-. 1,3-Propanediamine, n'-(ethylcarbonimidoyl)-n,n-dimethyl-.

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