Chemical Properties of cis-Phenanthrene, 9,10-dihydro-9-methyl-9,10-diol, 3,4-dimethoxy, diacetate

cis-Phenanthrene, 9,10-dihydro-9-methyl-9,10-diol, 3,4-dimethoxy, diacetate

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InChI
InChI=1S/C21H22O6/c1-12(22)26-20-15-10-11-17(24-4)19(25-5)18(15)14-8-6-7-9-16(14)21(20,3)27-13(2)23/h6-11,20H,1-5H3/t20-,21+/m1/s1
InChI Key
BMCSEJOBKZMRSX-RTWAWAEBSA-N
Formula
C21H22O6
SMILES
COc1ccc2c(c1OC)-c1ccccc1C(C)(OC(C)=O)C2OC(C)=O
Molecular Weight1
370.40
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Physical Properties

Property Value Unit Source
ΔfG° -305.95 kJ/mol Joback Calculated Property
ΔfH°gas -729.77 kJ/mol Joback Calculated Property
ΔfusH° 39.63 kJ/mol Joback Calculated Property
ΔvapH° 90.95 kJ/mol Joback Calculated Property
log10WS -5.42 Crippen Calculated Property
logPoct/wat 3.767 Crippen Calculated Property
McVol 274.990 ml/mol McGowan Calculated Property
Pc 1656.49 kPa Joback Calculated Property
Inp 2735.00 NIST
Tboil 948.62 K Joback Calculated Property
Tc 1181.31 K Joback Calculated Property
Tfus 659.25 K Joback Calculated Property
Vc 1.042 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [875.30; 972.76] J/mol×K [948.62; 1181.31] Show Hide
Cp,gas 875.30 J/mol×K 948.62 Joback Calculated Property
Cp,gas 892.13 J/mol×K 987.40 Joback Calculated Property
Cp,gas 908.57 J/mol×K 1026.18 Joback Calculated Property
Cp,gas 924.72 J/mol×K 1064.97 Joback Calculated Property
Cp,gas 940.72 J/mol×K 1103.75 Joback Calculated Property
Cp,gas 956.70 J/mol×K 1142.53 Joback Calculated Property
Cp,gas 972.76 J/mol×K 1181.31 Joback Calculated Property

Similar Compounds

cis-Phenanthrene, 9,10-dihydro-9-methyl-9,10-diol, 3-methoxy, diacetate. cis-Phenanthrene, 9,10-dihydro-9-methyl-9,10-diol, diacetate. 3-O,6-O,N-Triacetylnormorphine. 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. Ergocristine. Codeine-propionyl. 9H-Purine, 9-[2-deoxy-3-O-(trimethylsilyl)-«beta»-D-erythro-pentofuranosyl]-6-(trimethylsiloxy)-2-[(trimethylsilyl)amino]-, 5'-[bis(trimethylsilyl) phospate].

Find more compounds similar to cis-Phenanthrene, 9,10-dihydro-9-methyl-9,10-diol, 3,4-dimethoxy, diacetate.

Sources

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