Chemical Properties of Clobazam M (norhydroxy-), hydrolysis, acetlyated

Clobazam M (norhydroxy-), hydrolysis, acetlyated

InChI
InChI=1S/C18H17ClN2O4/c1-11(22)20-17-9-4-14(19)10-18(17)21(12(2)23)15-5-7-16(8-6-15)25-13(3)24/h4-10H,1-3H3,(H,20,22)
InChI Key
VHYKZAOYNAVBFY-UHFFFAOYSA-N
Formula
C18H17ClN2O4
SMILES
CC(=O)Nc1ccc(Cl)cc1N(C(C)=O)c1ccc(OC(C)=O)cc1
Molecular Weight1
360.80
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Physical Properties

Property Value Unit Source
ΔfusH° 49.17 kJ/mol Joback Calculated Property
IE 7.60 eV Relay (1.0) Calculated Property
log10WS -4.18 Relay (1.0) Calculated Property
logPoct/wat 3.908 Crippen Calculated Property
McVol 259.740 ml/mol McGowan Calculated Property
Inp [3000.00; 3000.00]   Show Hide
Inp 3000.00 NIST
Inp 3000.00 NIST

Cheméo can also estimate Normal Boiling Point Temperature, Normal melting (fusion) point, Critical Temperature, Critical Pressure, Critical Volume, Enthalpy of formation at standard conditions, Enthalpy of vaporization at standard conditions, Standard Gibbs free energy of formation, Acentric Factor for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.

Correlations

Property Value Unit Temperature (K) Source
Cp,gas [343.75; 771.13] 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 A2.73000e+00
Coefficient B1.47366e+00
Coefficient C-8.66280e-04
Coefficient D1.61020e-07
Coefficient E0.00000e+00
Temperature range, min.273.00
Temperature range, max.1000.00
Cp,gas 343.75 J/mol×K 273.00 Calculated Property
Cp,gas 422.79 J/mol×K 353.78 Calculated Property
Cp,gas 492.74 J/mol×K 434.56 Calculated Property
Cp,gas 554.14 J/mol×K 515.33 Calculated Property
Cp,gas 607.47 J/mol×K 596.11 Calculated Property
Cp,gas 653.26 J/mol×K 676.89 Calculated Property
Cp,gas 692.01 J/mol×K 757.67 Calculated Property
Cp,gas 724.23 J/mol×K 838.44 Calculated Property
Cp,gas 750.44 J/mol×K 919.22 Calculated Property
Cp,gas 771.13 J/mol×K 1000.00 Calculated Property

Similar Compounds

Clobazam M (norhydroxymethoxy-), hydrolysis, acetylated. 1H-1,5-Benzodiazepine-2,4(3H,5H)-dione, 8-chloro-1-phenyl-. 3',5'-Diacetylthymidine. THYMIDINE, 3'-(O-TERT.-BUTYLDIMETHYLSILYL)-5'-ACETYL-. Isothipendyl M (nor-hydroxy-), acetylated. (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. N6-(cyclotetramethylene-tertbutylsilyl)-2'-Deoxyadenosine, 3',5'-bis-O-TBDMS. Poligodial + o-Tyr (ethyl ester) adduct (R,S), acetylated, # 1. ethyl eburnamenine-14-carboxylate. Thymidine, 3'-O-acetyl, 5'-O-TBDMS. 2'-Deoxyguanosine, tris(trimethylsilyl) deriv.. Cytosine arabinoside, dimethyl-allyldimethylsilyl derivative. Thymine, 1-alpha-l-rhamnopyranosyl-. Formosanan-16-carboxylic acid, 19-methyl-2-oxo-, methyl ester, (19«alpha»)-. Thymidine, 3'-O-cyclotetramethylene-isopropylsilyl, 5'-O-acetyl.

Find more compounds similar to Clobazam M (norhydroxy-), hydrolysis, acetlyated.

Sources

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