Chemical Properties of 1-Amino-2-methoxy-4-p-tolylsulfonamido-anthraquinone (CAS 81-68-5)

1-Amino-2-methoxy-4-p-tolylsulfonamido-anthraquinone

PDF Excel Molecule Calculator
InChI
InChI=1S/C22H18N2O5S/c1-12-7-9-13(10-8-12)30(27,28)24-16-11-17(29-2)20(23)19-18(16)21(25)14-5-3-4-6-15(14)22(19)26/h3-11,24H,23H2,1-2H3
InChI Key
BXIGAWRFDMDLTL-UHFFFAOYSA-N
Formula
C22H18N2O5S
SMILES
COc1cc(NS(=O)(=O)c2ccc(C)cc2)c2c(c1N)C(=O)c1ccccc1C2=O
Molecular Weight1
422.45
CAS
81-68-5
Other Names
  • N-(4-amino-9,10-dihydro-3-methoxy-9,10-dioxo-1-anthryl)-4-methylbenzenesulphonamide
Cheméo is a service of Céondo GmbH, since 2007, we provide simulation, modelling and software development services for the industry. Do not hesitate to contact us for your projects.

Physical Properties

Property Value Unit Source
Δf -168.51 kJ/mol Joback Calculated Property
Δfgas -531.05 kJ/mol Joback Calculated Property
Δfus 53.57 kJ/mol Joback Calculated Property
Δvap 122.03 kJ/mol Joback Calculated Property
log10WS -5.37 Crippen Calculated Property
logPoct/wat 3.162 Crippen Calculated Property
McVol 295.760 ml/mol McGowan Calculated Property
Pc 2472.73 kPa Joback Calculated Property
Tboil 1148.36 K Joback Calculated Property
Tc 1418.14 K Joback Calculated Property
Tfus 850.93 K Joback Calculated Property
Vc 1.131 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [923.49; 942.30] J/mol×K [1148.36; 1418.14] Show Hide
Cp,gas 937.98 J/mol×K 1148.36 Joback Calculated Property
Cp,gas 941.29 J/mol×K 1193.32 Joback Calculated Property
Cp,gas 942.30 J/mol×K 1238.29 Joback Calculated Property
Cp,gas 941.02 J/mol×K 1283.25 Joback Calculated Property
Cp,gas 937.45 J/mol×K 1328.21 Joback Calculated Property
Cp,gas 931.61 J/mol×K 1373.17 Joback Calculated Property
Cp,gas 923.49 J/mol×K 1418.14 Joback Calculated Property

Similar Compounds

N-Desmethylmirtazapine. Thebacon. Benzylmorphine. Nicocodine. Buprenorphine. QUINIDINE, M(HO-), AC. 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 1-Amino-2-methoxy-4-p-tolylsulfonamido-anthraquinone.

Sources

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.