Chemical Properties of (S)?-??N-?Desmethylcitalopram (CAS 144025-14-9)

(S)?-??N-?Desmethylcitalopram

InChI
InChI=1S/C19H19FN2O/c1-22-10-2-9-19(16-4-6-17(20)7-5-16)18-8-3-14(12-21)11-15(18)13-23-19/h3-8,11,22H,2,9-10,13H2,1H3/t19-/m1/s1
InChI Key
PTJADDMMFYXMMG-LJQANCHMSA-N
Formula
C19H19FN2O
SMILES
CNCCCC1(c2ccc(F)cc2)OCc2cc(C#N)ccc21
Molecular Weight1
310.37
CAS
144025-14-9
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Physical Properties

Property Value Unit Source
ΔfusH° 41.38 kJ/mol Joback Calculated Property
logPoct/wat 3.471 Crippen Calculated Property
McVol 239.190 ml/mol McGowan Calculated Property
Inp [2508.30; 2508.30]   Show Hide
Inp 2508.30 NIST
Inp 2508.30 NIST

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Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [734.51; 836.08] J/mol×K [887.87; 1126.20] Show Hide
Cp,gas 734.51 J/mol×K 887.87 Joback Calculated Property
Cp,gas 750.72 J/mol×K 927.59 Joback Calculated Property
Cp,gas 766.93 J/mol×K 967.31 Joback Calculated Property
Cp,gas 783.34 J/mol×K 1007.03 Joback Calculated Property
Cp,gas 800.19 J/mol×K 1046.75 Joback Calculated Property
Cp,gas 817.70 J/mol×K 1086.47 Joback Calculated Property
Cp,gas 836.08 J/mol×K 1126.20 Joback Calculated Property

Similar Compounds

Citalopram, bis-nor, acetyl. Citalopram. Citalopram, nor, acetyl. 7-[(2-hydroxy-2-phenylacetyl)amino]-3-[(1-methyltetrazol-5-yl)sulfanylmethyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid. 1H-pyrazolo[3,4-d]pyrimidine, 4-(methylthio)-1-beta-d-ribofuranosyl-, 2',3',5'-tribenzoate. Yohimbine. risperidone. Poligodial + 3-methoxy-4,5-methylenedioxyamphetamine (R,S) adduct, # 1. Poligodial + 3-methoxy-4,5-methylenedioxyamphetamine (R,S) adduct, # 2. Ibogaine. Vobassan-17-oic acid, 4-demethyl-3-oxo-, methyl ester. Cialis. 2-Hydroxy-2-phenylethylamine, ferrocenylboronate. QUINIDINE, M(N-OXIDE), AC. QUINIDINE, AC.

Find more compounds similar to (S)?-??N-?Desmethylcitalopram.

Sources

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