Chemical Properties of Sertraline, nor, acetyl

Sertraline, nor, acetyl

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InChI
InChI=1S/C18H17Cl2NO/c1-11(22)21-18-9-7-13(14-4-2-3-5-15(14)18)12-6-8-16(19)17(20)10-12/h2-6,8,10,13,18H,7,9H2,1H3,(H,21,22)/t13-,18-/m0/s1
InChI Key
YIQKGDBXOASLSF-UGSOOPFHSA-N
Formula
C18H17Cl2NO
SMILES
CC(=O)NC1CCC(c2ccc(Cl)c(Cl)c2)c2ccccc21
Molecular Weight1
334.24
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Physical Properties

Property Value Unit Source
ΔfG° 274.16 kJ/mol Joback Calculated Property
ΔfH°gas -20.49 kJ/mol Joback Calculated Property
ΔfusH° 41.49 kJ/mol Joback Calculated Property
ΔvapH° 83.93 kJ/mol Joback Calculated Property
log10WS -6.28 Crippen Calculated Property
logPoct/wat 5.096 Crippen Calculated Property
McVol 242.130 ml/mol McGowan Calculated Property
Pc 2056.76 kPa Joback Calculated Property
Inp 2700.00 NIST
Tboil 864.78 K Joback Calculated Property
Tc 1117.11 K Joback Calculated Property
Tfus 555.63 K Joback Calculated Property
Vc 0.914 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [691.11; 759.62] J/mol×K [864.78; 1117.11] Show Hide
Cp,gas 691.11 J/mol×K 864.78 Joback Calculated Property
Cp,gas 705.29 J/mol×K 906.83 Joback Calculated Property
Cp,gas 718.23 J/mol×K 948.89 Joback Calculated Property
Cp,gas 730.02 J/mol×K 990.94 Joback Calculated Property
Cp,gas 740.78 J/mol×K 1033.00 Joback Calculated Property
Cp,gas 750.61 J/mol×K 1075.05 Joback Calculated Property
Cp,gas 759.62 J/mol×K 1117.11 Joback Calculated Property

Similar Compounds

N-Desmethylmirtazapine. Zinc octaethylporphyrin chloride. Buprenorphine. 9H-Purine, 9-[2-deoxy-3-O-(trimethylsilyl)-«beta»-D-erythro-pentofuranosyl]-6-(trimethylsiloxy)-2-[(trimethylsilyl)amino]-, 5'-[bis(trimethylsilyl) phospate]. 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.

Find more compounds similar to Sertraline, nor, acetyl.

Sources

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