Chemical Properties of Trans-3-benzoyl-4-phenyl-1-methylpiperdine (CAS 116595-02-9)

Trans-3-benzoyl-4-phenyl-1-methylpiperdine

InChI
InChI=1S/C19H21NO/c1-20-13-12-17(15-8-4-2-5-9-15)18(14-20)19(21)16-10-6-3-7-11-16/h2-11,17-18H,12-14H2,1H3
InChI Key
XYCHMYKPKLTNDM-UHFFFAOYSA-N
Formula
C19H21NO
SMILES
CN1CCC(c2ccccc2)C(C(=O)c2ccccc2)C1
Molecular Weight1
279.38
CAS
116595-02-9
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Physical Properties

Property Value Unit Source
ω 0.5159 Relay (1.0) Calculated Property
ΔfG° 274.05 kJ/mol Relay (1.0-beta) Calculated Property
ΔfH°gas 84.30 kJ/mol Relay (1.0) Calculated Property
ΔvapH° 109.45 kJ/mol Relay (1.0) Calculated Property
IE 8.26 eV Relay (1.0) Calculated Property
log10WS -2.89 Relay (1.0) Calculated Property
logPoct/wat 3.605 Crippen Calculated Property
McVol 231.740 ml/mol McGowan Calculated Property
Pc 1858.85 kPa Relay (1.0-beta) Calculated Property
Tboil 653.12 K Relay (1.0) Calculated Property
Tc 921.32 K Relay (1.0) Calculated Property
Tfus 417.58 K Relay (1.0) Calculated Property
Vc 0.818 m3/kmol Relay (1.0) Calculated Property

Similar Compounds

risperidone. 1H-pyrazolo[3,4-d]pyrimidine, 4-(methylthio)-1-beta-d-ribofuranosyl-, 2',3',5'-tribenzoate. Vobassan-17-oic acid, 4-demethyl-3-oxo-, methyl ester. Hypoxanthine-7-ethanol, 2,3-dihydro-3-(diphenylmethyl)-, acetate. SCHEMBL9488362. 2-Piperidinomethyl-8(ar)-methoxy-tetrahydro-1-acenaphthone. Mephenesin, 2-(N,N-dimethylaminomethyl)-ferroceneboronate. (1,S,2S,3R,5S)-(+)-Pinanediol, , 2-(N,N-dimethylaminomethyl)-ferroceneboronate. 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. Ergocristine.

Find more compounds similar to Trans-3-benzoyl-4-phenyl-1-methylpiperdine.

Sources

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