Chemical Properties of Tofisopam (CAS 22345-47-7)

Tofisopam

InChI
InChI=1S/C22H26N2O4/c1-7-15-13(2)23-24-22(14-8-9-18(25-3)19(10-14)26-4)17-12-21(28-6)20(27-5)11-16(15)17/h8-12,15H,7H2,1-6H3
InChI Key
RUJBDQSFYCKFAA-UHFFFAOYSA-N
Formula
C22H26N2O4
SMILES
CCC1C(C)=NN=C(c2ccc(OC)c(OC)c2)c2cc(OC)c(OC)cc21
Molecular Weight1
382.45
CAS
22345-47-7
Other Names
  • 5H-2,3-Benzodiazepine, 1-(3,4-dimethoxyphenyl)-5-ethyl-7,8-dimethoxy-4-methyl-
  • 1-(3,4-Dimethoxyphenyl)-5-ethyl-7,8-dimethoxy-4-methyl-5H-2,3-benzodiazepine
  • Egyt 341
  • Grandaxin
  • TF
  • Seriel
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Physical Properties

Property Value Unit Source
ω 0.9274 Relay (1.0) Calculated Property
ΔfG° 201.80 kJ/mol Joback Calculated Property
ΔfH°gas -222.51 kJ/mol Relay (1.0) Calculated Property
ΔfusH° 49.50 kJ/mol Joback Calculated Property
ΔvapH° 118.00 kJ/mol Relay (1.0) Calculated Property
IE 7.14 eV Relay (1.0) Calculated Property
log10WS -4.31 Relay (1.0) Calculated Property
logPoct/wat 4.441 Crippen Calculated Property
McVol 297.300 ml/mol McGowan Calculated Property
Pc 1494.19 kPa Joback Calculated Property
Inp 3055.00 NIST
Tboil 714.23 K Relay (1.0) Calculated Property
Tc 992.08 K Relay (1.0) Calculated Property
Tfus 437.69 K Relay (1.0) Calculated Property
Vc 1.066 m3/kmol Relay (1.0) Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [1000.48; 1029.31] J/mol×K [1001.66; 1245.75] Show Hide
Cp,gas 1000.48 J/mol×K 1001.66 Joback Calculated Property
Cp,gas 1011.63 J/mol×K 1042.34 Joback Calculated Property
Cp,gas 1020.15 J/mol×K 1083.02 Joback Calculated Property
Cp,gas 1025.98 J/mol×K 1123.71 Joback Calculated Property
Cp,gas 1029.06 J/mol×K 1164.39 Joback Calculated Property
Cp,gas 1029.31 J/mol×K 1205.07 Joback Calculated Property
Cp,gas 1026.67 J/mol×K 1245.75 Joback Calculated Property

Similar Compounds

Retroisosenine. 5,6-Dihydrouracil riboside, TMS. N-Desmethylmirtazapine. Hydroxy-N-methylcytisine. Vobassan-17-oic acid, 4-demethyl-3-oxo-, methyl ester. Retroisosensine. Benzquinamide. Morphine-3-acetate. Hydromorphone, tert-butyldimethylsilyl ether. Codeine-propionyl. Mephenesin, 2-(N,N-dimethylaminomethyl)-ferroceneboronate. Paclitaxel. Triazolo[4,5-d]pyrimidin-7-ol,3h-v-, 5-amino-3-(2',3'-o-isopropylidene-beta-d-ribofuranosyl)-, 5'-diphenyl phosphate (keto form). Morphinan-3,6-diol, 7,8-didehydro-4,5-epoxy-17-methyl- (5«alpha»,6«alpha»)-, bis(trifluoroacetate) (ester). Methyldesorphine.

Find more compounds similar to Tofisopam.

Sources

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