Chemical Properties of Diethyl isocyanato succinate (CAS 17046-24-1)

Diethyl isocyanato succinate

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InChI
InChI=1S/C9H13NO5/c1-3-14-8(12)5-7(10-6-11)9(13)15-4-2/h7H,3-5H2,1-2H3
InChI Key
GQPSHLZKDVRQFJ-UHFFFAOYSA-N
Formula
C9H13NO5
SMILES
CCOC(=O)CC(N=C=O)C(=O)OCC
Molecular Weight1
215.20
CAS
17046-24-1
Sources

Physical Properties

Property Value Unit Source
Δfgas -729.38 kJ/mol Joback Calculated Property
Δvap 63.08 kJ/mol Joback Calculated Property
logPoct/wat 0.21 Crippen Calculated Property
Pc 2746.90 kPa Joback Calculated Property
Tboil 624.13 K Joback Calculated Property
Tc 816.63 K Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
>CH- 1
-O- (nonring) 2
=C= 1
>C=O (nonring) 2
-N= 1
-CH2- 3
=O 1
-CH3 2

Similar Compounds

2-Isothiocyanato-succinic acid diethyl ester. Aspartic acid, N-acetyl-, diethyl ester, L-. 2-Isothiocyanato-butyric acid ethyl ester. Dimethyl isothiocyanatosuccinate. Di-n-butyl l(+)-aspartate hydrochloride. Ethyl 2-isocyanato-4-methyl valerate. Ethyl alpha-isocyanato gamma-thiomethyl butyrate. Ethyl 2-isocyanato-4-methylthiobutyrate. Phenyl 1,2-dicarbethoxyethylcarbamate. Aspartic acid, dimethyl ester. L-2-Aminobutyric acid, N-dimethylaminomethylene-, butyl ester. 2-Isothiocyanato-3-methylbutyric acid ethyl ester. 2-Aminopent-4-enoic acid, N-hexyloxycarbonyl-, pentyl ester. 2-Aminopent-4-enoic acid, N-hexyloxycarbonyl-, hexyl ester. 2-Aminopent-4-enoic acid, N-hexyloxycarbonyl-, nonyl ester.

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