Chemical Properties of 2-Dimethylamino-8(ar)-methoxy-tetrahydro-1-acenaphthone (CAS 116296-20-9)

2-Dimethylamino-8(ar)-methoxy-tetrahydro-1-acenaphthone

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InChI
InChI=1S/C16H21NO2/c1-17(2)9-12-11-6-4-5-10-7-8-13(19-3)15(14(10)11)16(12)18/h7-8,11-12H,4-6,9H2,1-3H3
InChI Key
QXXUCXAVKQQQEZ-UHFFFAOYSA-N
Formula
C16H21NO2
SMILES
COc1ccc2c3c1C(=O)C(CN(C)C)C3CCC2
Molecular Weight1
259.34
CAS
116296-20-9
Sources

Physical Properties

Property Value Unit Source
Δf 172.05 kJ/mol Joback Calculated Property
Δfgas -228.24 kJ/mol Joback Calculated Property
Δfus 30.06 kJ/mol Joback Calculated Property
Δvap 64.00 kJ/mol Joback Calculated Property
logPoct/wat 2.49 Crippen Calculated Property
Pc 2081.22 kPa Joback Calculated Property
Tboil 723.26 K Joback Calculated Property
Tc 947.48 K Joback Calculated Property
Tfus 492.86 K Joback Calculated Property
Vc 0.78 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 621.97 J/mol×K 723.26 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
-O- (nonring) 1
>C=O (ring) 1
=CH- (ring) 2
>N- 1
=C< (ring) 4
-CH2- 1
-CH3 3
>CH- (ring) 2
-CH2- (ring) 3

Similar Compounds

2-Piperidinomethyl-8(ar)-methoxy-tetrahydro-1-acenaphthone. Morphinan-6-one, 4,5-epoxy-3,14-dihydroxy-17-(2-propenyl)-, (5«alpha»)-. Naloxone. Metopon. Hydrocodone. Morphinone, dihydro-. Morphinan-6-one, 4,5-epoxy-3-hydroxy-17-methyl-, (5.alpha.)-. Naltrexone. Dihydromorphinone acetate. Oxycodone. Oxymorphone. Codeinone, 14-hydroxy-. Hydromorphone, trimethylsilyl ether. Naloxone, bis(trimethylsilyl) ether. Hydromorphone, tert-butyldimethylsilyl ether.

Find more compounds similar to 2-Dimethylamino-8(ar)-methoxy-tetrahydro-1-acenaphthone.

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