Chemical Properties of Furo[3',4':6,7]naphtho[2,3-d]-1,3-dioxol-6(5aH)-one, 5,8,8a,9-tetrahydro-5-(3,4,5-trimethoxyphenyl)-, [5R-(5«alpha»,5a«beta»,8a«alpha»)]- (CAS 19186-35-7)

Furo[3',4':6,7]naphtho[2,3-d]-1,3-dioxol-6(5aH)-one, 5,8,8a,9-tetrahydro-5-(3,4,5-trimethoxyphenyl)-, [5R-(5«alpha»,5a«beta»,8a«alpha»)]-

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InChI
InChI=1S/C22H22O7/c1-24-17-6-12(7-18(25-2)21(17)26-3)19-14-8-16-15(28-10-29-16)5-11(14)4-13-9-27-22(23)20(13)19/h5-8,13,19-20H,4,9-10H2,1-3H3
InChI Key
ZGLXUQQMLLIKAN-UHFFFAOYSA-N
Formula
C22H22O7
SMILES
COc1cc(C2c3cc4c(cc3CC3COC(=O)C32)OCO4)cc(OC)c1OC
Molecular Weight1
398.41
CAS
19186-35-7
Other Names
  • Podophyllotoxin, deoxy-
  • Anthricin
  • Deoxypodophyllotoxin
  • Desoxypodophyllotoxin
  • Hernandion
  • Silicicolin
  • Hernandin
  • 5-(3,4,5-Trimethoxyphenyl)-5,8,8a,9-tetrahydrofuro[3',4':6,7]naphtho[2,3-d][1,3]dioxol-6(5ah)-one-, (5R,5aR,8aR)-
  • (-)-Anthricin
  • (-)-Deoxypodophyllotoxin
  • (-)-Desoxypodophyllotoxin
  • 4-Deoxypodophyllotoxin
  • AS 2-3
  • Furo[3',4':6,7]naphtho[2,3-d]-1,3-dioxol-6(5aH)-one, 5,8,8a,9-tetrahydro-5-(3,4,5-trimethoxyphenyl)-, (5R,5aR,8aR)-
  • (5R,5aR,8aR)-5-(3,4,5-Trimethoxyphenyl)-5,5a,8a,9-tetrahydrofuro[3',4':6,7]naphtho[2,3-d][1,3]dioxol-6(8H)-one
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Physical Properties

Property Value Unit Source
ΔfG° -224.40 kJ/mol Joback Calculated Property
ΔfH°gas -811.29 kJ/mol Joback Calculated Property
ΔfusH° 57.80 kJ/mol Joback Calculated Property
ΔvapH° 98.01 kJ/mol Joback Calculated Property
log10WS -4.33 Crippen Calculated Property
logPoct/wat 2.918 Crippen Calculated Property
McVol 277.530 ml/mol McGowan Calculated Property
Pc 1756.54 kPa Joback Calculated Property
Inp 3267.50 NIST
Tboil 1026.42 K Joback Calculated Property
Tc 1278.49 K Joback Calculated Property
Tfus 730.58 K Joback Calculated Property
Vc 1.038 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [962.08; 1015.55] J/mol×K [1026.42; 1278.49] Show Hide
Cp,gas 962.08 J/mol×K 1026.42 Joback Calculated Property
Cp,gas 974.83 J/mol×K 1068.43 Joback Calculated Property
Cp,gas 985.98 J/mol×K 1110.44 Joback Calculated Property
Cp,gas 995.57 J/mol×K 1152.46 Joback Calculated Property
Cp,gas 1003.66 J/mol×K 1194.47 Joback Calculated Property
Cp,gas 1010.31 J/mol×K 1236.48 Joback Calculated Property
Cp,gas 1015.55 J/mol×K 1278.49 Joback Calculated Property

Similar Compounds

Nalmefene. 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). QUINIDINE, M(HO-), AC. 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 Furo[3',4':6,7]naphtho[2,3-d]-1,3-dioxol-6(5aH)-one, 5,8,8a,9-tetrahydro-5-(3,4,5-trimethoxyphenyl)-, [5R-(5«alpha»,5a«beta»,8a«alpha»)]-.

Sources

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