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
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Physical Properties

Property Value Unit Source
ω 0.6268 Relay (... Calculated Property
ΔfG° 172.05 kJ/mol Joback Calculated Property
ΔfH°gas -256.62 kJ/mol Relay (... Calculated Property
ΔfusH° 30.06 kJ/mol Joback Calculated Property
ΔvapH° 93.68 kJ/mol Relay (... Calculated Property
IE 7.75 eV Relay (... Calculated Property
log10WS -3.04 Relay (... Calculated Property
logPoct/wat 2.489 Crippen Calculated Property
McVol 208.240 ml/mol McGowan Calculated Property
Pc 2081.22 kPa Joback Calculated Property
Tboil 635.94 K Relay (... Calculated Property
Tc 884.18 K Relay (... Calculated Property
Tfus 409.85 K Relay (... Calculated Property
Vc 0.764 m3/kmol Relay (... Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [621.97; 715.40] J/mol×K [723.26; 947.48] Show Hide
Cp,gas 621.97 J/mol×K 723.26 Joback Calculated Property
Cp,gas 640.28 J/mol×K 760.63 Joback Calculated Property
Cp,gas 657.42 J/mol×K 798.00 Joback Calculated Property
Cp,gas 673.43 J/mol×K 835.37 Joback Calculated Property
Cp,gas 688.40 J/mol×K 872.74 Joback Calculated Property
Cp,gas 702.37 J/mol×K 910.11 Joback Calculated Property
Cp,gas 715.40 J/mol×K 947.48 Joback Calculated Property

Similar Compounds

2-Piperidinomethyl-8(ar)-methoxy-tetrahydro-1-acenaphthone. Tazettine. 3-O,6-O,N-Triacetylnormorphine. Benzylmorphine. Nicocodine. Buprenorphine. Dihydroergokryptine. Crinan-11-ol, 1,2-didehydro-3-methoxy-, (3«beta»,5«alpha»,11R,13«beta»,19«alpha»)-. [2,2'-Bimorphinan]-3,3',6,6'-tetrol, 7,7',8,8'-tetradehydro-4,5:4',5'-diepoxy-17,17'-dimethyl-, (5«alpha»,6«alpha»)-(5'«alpha»,6'«alpha»)-. Morphinan-3,6-diol, 7,8-didehydro-4,5-epoxy-17-methyl- (5«alpha»,6«alpha»)-, bis(trifluoroacetate) (ester). Triazolo[4,5-d]pyrimidin-7-ol,3h-v-, 5-amino-3-(2',3'-o-isopropylidene-beta-d-ribofuranosyl)-, 5'-diphenyl phosphate (keto form). Deserpidine. Paclitaxel. Ergotaman-3',6',18-trione, 9,10-dihydro-12'-hydroxy-2'-methyl-5'-(phenylmethyl)-, (5'«alpha»,10«alpha»)-. Ergotamine.

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

Sources

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