Chemical Properties of Benzoic acid, 2-{3-[2-(diethylamino)ethyl]-3-methyltriazeno}-, methyl ester (CAS 127909-49-3)

Benzoic acid, 2-{3-[2-(diethylamino)ethyl]-3-methyltriazeno}-, methyl ester

InChI
InChI=1S/C15H24N4O2/c1-5-19(6-2)12-11-18(3)17-16-14-10-8-7-9-13(14)15(20)21-4/h7-10H,5-6,11-12H2,1-4H3/b17-16+
InChI Key
XPOKLMOUTMGTBB-WUKNDPDISA-N
Formula
C15H24N4O2
SMILES
CCN(CC)CCN(C)N=Nc1ccccc1C(=O)OC
Molecular Weight1
292.38
CAS
127909-49-3
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Physical Properties

Property Value Unit Source
ΔfH°gas -113.60 kJ/mol Relay (1.0) Calculated Property
IE 7.89 eV Relay (1.0) Calculated Property
log10WS -2.05 Relay (1.0) Calculated Property
logPoct/wat 2.745 Crippen Calculated Property
McVol 241.510 ml/mol McGowan Calculated Property
Pc 1475.88 kPa Joback Calculated Property
Tboil 616.92 K Relay (1.0) Calculated Property
Tfus 285.52 K Relay (1.0) Calculated Property

Cheméo can also estimate Critical Temperature, Critical Volume, 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.

Similar Compounds

Benzoic acid, 2-(3-cyclohexyl-3-methyltriazeno)-, methyl ester. 4',5'-Diiodofluorescein. Lysergol. 2(1H)-Pyrimidinone, 1-[2,3-bis-O-(trimethylsilyl)-«beta»-D-ribofuranosyl]-4-(trimethylsiloxy)-, 5'-[bis(trimethylsilyl) phosphate]. 5-Methoxytryptophan, ethoxycarbonylated, TBDMS. 2-Dimethylamino-8(ar)-methoxy-tetrahydro-1-acenaphthone. (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. Uridine, 2'-O-acetyl, 3',5'-bis-O-TBDMS. inosine-5'-monophosphate, TMS. 9H-purine-6(1h)-thione, 9-beta-d-ribofuranosyl-, 2',3'-diacetate, 5'-bis(3,5-dimethylphenyl)phosphate. Bicyclohexyl-1,1'-diol, , 2-(N,N-dimethylaminomethyl)-ferroceneboronate. Methyldihydromorphine. DIHYDROMORPHINE. Hydromorphone. 2'-Deoxyguanosine, tris(trimethylsilyl) deriv..

Find more compounds similar to Benzoic acid, 2-{3-[2-(diethylamino)ethyl]-3-methyltriazeno}-, methyl ester.

Sources

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