Chemical Properties of 2,3,4,5,6,7-hexahydro-cyclopent[b]azepin-8(1H)-one

2,3,4,5,6,7-hexahydro-cyclopent[b]azepin-8(1H)-one

Download as PDF file Download as Excel file Download as 2D mole file Predict properties

InChI
InChI=1S/C9H13NO/c11-8-5-4-7-3-1-2-6-10-9(7)8/h10H,1-6H2
InChI Key
XZTJVKYWRODILK-UHFFFAOYSA-N
Formula
C9H13NO
SMILES
O=C1CCC2=C1NCCCC2
Molecular Weight1
151.21
Sources

Physical Properties

Property Value Unit Source
Δf 89.24 kJ/mol Joback Calculated Property
Δfgas -132.50 kJ/mol Joback Calculated Property
Δfus 14.34 kJ/mol Joback Calculated Property
Δvap 49.38 kJ/mol Joback Calculated Property
logPoct/wat 1.38 Crippen Calculated Property
Pc 3955.54 kPa Joback Calculated Property
Tboil 570.71 K Joback Calculated Property
Tc 824.07 K Joback Calculated Property
Tfus 420.52 K Joback Calculated Property
Vc 0.45 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 302.34 J/mol×K 570.71 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
=C< (ring) 2
>C=O (ring) 1
>NH (ring) 1
-CH2- (ring) 6

Similar Compounds

1,2,3,4,5,6-hexahydro-7H-cyclopenta[b]pyridin-7-one. 7-methyl-2,3,4,5,6,7-hexahydrocyclopent[b]azepin-8(1H)-one. 6-methyl-1,2,3,4,5,6-hexahydro-7H-cyclopenta[b]pyridin-7-one. 5-methyl-1,2,3,4,5,6-hexahydro-7H-cyclopenta[b]pyridin-7-one. 6-ethyl-1,2,3,4,5,6-hexahydro-7H-cyclopenta[b]pyridin-7-one. 2-Propionyl-1,4,5,6-tetrahydropyridine. 5-(1-hydroxyethylidene)-hexahydro-7H-cyclopenta[b]pyridin-7-one. 6,7-dimethyl-2,3,6,7-tetrahydro-cyclopent[b]azepin-8(1H)-one. 2-(1-pyrrolidinyl)-2-cyclopenten-1-one. 2-Acetyl-1,4,5,6-tetrahydropyridine. 1,2-bis-(1-Pyrrolidinyl)-1-buten-3-one. maltoxazine. 2-acetyl-2-pyrroline. 2,5-dimethyl-4-(1-pyrrolidinyl)-3(2H)-furanone. Succinimide, 2-[2-(2-oxocyclohexyl)-2-oxoethyl]-.

Find more compounds similar to 2,3,4,5,6,7-hexahydro-cyclopent[b]azepin-8(1H)-one.

Note: Cheméo is only indexing the data, follow the source links to retrieve the latest data. The source is also providing more information like the publication year, authors and more. Take the time to validate and double check the source of the data.