Chemical Properties of 2-Diazo-6-oxo-2,6-dihydroazulene-1,3-dicarboxylic acid, diethyl ester

2-Diazo-6-oxo-2,6-dihydroazulene-1,3-dicarboxylic acid, diethyl ester

InChI
InChI=1S/C16H14N2O5/c1-3-22-15(20)12-10-7-5-9(19)6-8-11(10)13(14(12)18-17)16(21)23-4-2/h5-8H,3-4H2,1-2H3
InChI Key
MXIFEOYDIGRKLQ-UHFFFAOYSA-N
Formula
C16H14N2O5
SMILES
CCOC(=O)C1=c2ccc(=O)ccc2=C(C(=O)OCC)C1=[N+]=[N-]
Molecular Weight1
314.30
Cheméo is a service of Céondo GmbH, since 2007, we provide simulation, modelling and software development services for the industry. Do not hesitate to contact us for your projects.

Physical Properties

Property Value Unit Source
ΔfH°gas -388.65 kJ/mol Relay (1.0) Calculated Property
ΔvapH° 103.53 kJ/mol Relay (1.0) Calculated Property
log10WS -3.46 Relay (1.0) Calculated Property
logPoct/wat -0.841 Crippen Calculated Property
McVol 225.190 ml/mol McGowan Calculated Property
Pc 1658.44 kPa Relay (1.0-beta) Calculated Property
Tboil 666.36 K Relay (1.0) Calculated Property
Tfus 398.90 K Relay (1.0) Calculated Property

Cheméo can also estimate Critical Temperature, Critical Volume, Standard Gibbs free energy of formation, Acentric Factor, Ionization energy 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

pimaricin. Carteolol, acetylated. 5-Pregnen-3-«alpha»,20-«alpha»-diol-20-GlcNAc TMS. Leu-Trp, N-trimethylsilyl-, trimethylsilyl ester. Ibogaine. Yohimbine. Ni-TETMP complex. 5-Pregnen-3-«beta»-ol, 20-«alpha»-GlcNAc, MeTMS. Ceftazidime. Adenosine, N-(trimethylsilyl)-2',3'-bis-O-(trimethylsilyl)-, 5'-[bis(trimethylsilyl) phosphate]. 5'-S-Methyl-5'-thioadenosine, O,O'-bis(trifluoroacetyl)-. Thymidine, 3'-O-cyclotetramethylene-tertbutylsilyl, 5'-O-acetyl. Vobassan-17-oic acid, 4-demethyl-3-oxo-, methyl ester. Thymine, 1-alpha-l-rhamnopyranosyl-. 5-Hydroxy-tetraline-cis-2,3-diol, ferrocenylboronate.

Find more compounds similar to 2-Diazo-6-oxo-2,6-dihydroazulene-1,3-dicarboxylic acid, diethyl ester.

Sources

Note: Cheméo is only indexing the data, follow the source links to retrieve the latest data. The source is also providing more information like the publication year, authors and more. Take the time to validate and double check the source of the data.