Chemical Properties of Ketotifen M (nor), acetylated

Ketotifen M (nor), acetylated

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InChI
InChI=1S/C20H19NO2S/c1-13(22)21-9-6-14(7-10-21)19-16-5-3-2-4-15(16)12-18(23)20-17(19)8-11-24-20/h2-5,8,11H,6-7,9-10,12H2,1H3
InChI Key
DZZDDFWCAOAASM-UHFFFAOYSA-N
Formula
C20H19NO2S
SMILES
CC(=O)N1CCC(=C2c3ccccc3CC(=O)c3sccc32)CC1
Molecular Weight1
337.44
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Physical Properties

Property Value Unit Source
ω 0.6698 Relay (... Calculated Property
ΔfG° 169.87 kJ/mol Relay (... Calculated Property ⚠️
ΔfH°gas -75.96 kJ/mol Relay (... Calculated Property
ΔvapH° 120.00 kJ/mol Relay (... Calculated Property
IE 8.20 eV Relay (... Calculated Property
log10WS -3.61 Relay (... Calculated Property
logPoct/wat 3.931 Crippen Calculated Property
McVol 252.890 ml/mol McGowan Calculated Property
Pc 1840.17 kPa Relay (... Calculated Property ⚠️
Inp 3180.00 NIST
Tboil 729.29 K Relay (... Calculated Property
Tc 1040.85 K Relay (... Calculated Property
Tfus 473.72 K Relay (... Calculated Property
Vc 0.879 m3/kmol Relay (... Calculated Property

Similar Compounds

10H-Benzo[4,5]cyclohepta[1,2-b]thiophen-10-one, 4,9-dihydro-4-(1-methyl-4-piperidinylidene)-. Pizotyline. azadirachtin. (2-Hydroxy-3-phenyl-1,2-dihydroquinoxalin-1-yl)phenyl(3-phenyl-1-benzyl-1,2-dihydroquinoxalin-2-yl)methane. Methysergide. Heptafluorobutyryl-codeine. 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. Ergocristine.

Find more compounds similar to Ketotifen M (nor), acetylated.

Sources

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