Chemical Properties of L-Cysteine, N,S-bis(5-chlorovaleryl)-, methyl ester

L-Cysteine, N,S-bis(5-chlorovaleryl)-, methyl ester

InChI
InChI=1S/C14H23Cl2NO4S/c1-21-14(20)11(17-12(18)6-2-4-8-15)10-22-13(19)7-3-5-9-16/h11H,2-10H2,1H3,(H,17,18)
InChI Key
ICIWTKWNAHYPRV-UHFFFAOYSA-N
Formula
C14H23Cl2NO4S
SMILES
COC(=O)C(CSC(=O)CCCCCl)NC(=O)CCCCCl
Molecular Weight1
372.31
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Physical Properties

Property Value Unit Source
ΔfusH° 53.68 kJ/mol Joback Calculated Property
logPoct/wat 2.722 Crippen Calculated Property
McVol 269.510 ml/mol McGowan Calculated Property
Inp [2892.00; 2892.00]   Show Hide
Inp 2892.00 NIST
Inp 2892.00 NIST

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Correlations

Property Value Unit Temperature (K) Source
Cp,gas [383.84; 808.31] J/mol×K [273.00; 1000.00] Joback Predicted correlation Show Hide
EquationY = A + B·T + C·T² + D·T³ + E·T⁴
Y is Cp,gas in J/mol×K, T in K
Coefficient A7.27790e+01
Coefficient B1.31311e+00
Coefficient C-6.58200e-04
Coefficient D8.06200e-08
Coefficient E0.00000e+00
Temperature range, min.273.00
Temperature range, max.1000.00
Cp,gas 383.84 J/mol×K 273.00 Calculated Property
Cp,gas 458.52 J/mol×K 353.78 Calculated Property
Cp,gas 525.72 J/mol×K 434.56 Calculated Property
Cp,gas 585.70 J/mol×K 515.33 Calculated Property
Cp,gas 638.73 J/mol×K 596.11 Calculated Property
Cp,gas 685.04 J/mol×K 676.89 Calculated Property
Cp,gas 724.90 J/mol×K 757.67 Calculated Property
Cp,gas 758.56 J/mol×K 838.44 Calculated Property
Cp,gas 786.28 J/mol×K 919.22 Calculated Property
Cp,gas 808.31 J/mol×K 1000.00 Calculated Property

Similar Compounds

l-Cysteine, N,S-bis(caproyl)-, methyl ester. L-Cysteine, N,S-bis(3-cyclopentylpropionyl)-, methyl ester. 7-tiglyl echinatine, diTMS. 7-angelyl echinatine, diTMS. Acetyl ester of echimidine, diTMS. 7-acetyl echinatine, diTMS. Echimidine, triTMS. Formosanan-16-carboxylic acid, 19-methyl-2-oxo-, methyl ester, (19«alpha»)-. 5'-S-Methyl-5'-thioadenosine, O,O'-bis(trifluoroacetyl)-. (1'S,3R,4a'S,5a'S,10a'S)-Methyl 1'-methyl-2-oxo-1',4a',5',5a',7',8',10',10a'-octahydrospiro[indoline-3,6'-pyrano[3,4-f]indolizine]-4'-carboxylate. Moexipril Me. Cialis. Poligodial + 3-methoxy-4,5-methylenedioxyamphetamine (R,S) adduct, # 1. 3'-Deoxyguanosine, tris(trimethylsilyl) deriv.. 1-Methyl-6«alpha»,7«alpha»-dihydroxyestrone, TMS.

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Sources

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