Chemical Properties of 5-NITROFURFURYLIDENE DIACETATE

5-NITROFURFURYLIDENE DIACETATE

InChI
InChI=1S/C9H9NO7/c1-5(11)15-9(16-6(2)12)7-3-4-8(17-7)10(13)14/h3-4,9H,1-2H3
InChI Key
HSXKWKJCZNRMJO-UHFFFAOYSA-N
Formula
C9H9NO7
SMILES
CC(=O)OC(OC(C)=O)c1ccc([N+](=O)[O-])o1
Molecular Weight1
243.17
Other Names
  • 5-Nitro-2-furaldehyde diacetate
  • 5-Nitrofurfurylidene diacetate
  • 5-Nitrofurfural diacetate
  • Methanediol, (5-nitro-2-furanyl)-, diacetate
  • Methanediol, (5-nitro-2-furanyl)-, diacetate (ester)
  • Nitrofuraldehyde diacetate
  • 2-Furanmethanediol, 5-nitro-, diacetate
  • 5-Nitro-2-furancarboxaldehyde diacetate
  • 5-Nitro-2-furanmethandiol diacetate
  • 5-Nitro-2-furanmethanediol diacetate
  • 5-Nitro-2-furfural diacetate
  • 5-Nitro-2-furfuraldehyde diacetate
  • 5-Nitrofuraldehyde diacetate
  • Methanediol, 1-(5-nitro-2-furanyl)-, 1,1-diacetate
  • NSC 5411
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
ΔcH°solid -3930.00 ± 0.80 kJ/mol NIST
ΔfH°gas -772.00 ± 3.00 kJ/mol NIST
ΔfH°solid -897.90 ± 0.80 kJ/mol NIST
logPoct/wat 1.313 Crippen Calculated Property
McVol 156.380 ml/mol McGowan Calculated Property
Tfus 325.22 K Relay (1.0) Calculated Property

Cheméo can also estimate Normal Boiling Point Temperature, Critical Temperature, Critical Pressure, Critical Volume, Enthalpy of vaporization at standard conditions, Standard Gibbs free energy of formation, Acentric Factor, Ionization energy, Log10 of Water solubility in mol/l 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.

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
ΔsubH 126.00 ± 3.00 kJ/mol 288.00 NIST

Similar Compounds

Pimozide. Inosine, 2',3',5'-tribenzoate. Uridine, 2',3',5'-tris-O-acetyl. propyl-«delta»1-tetrahydrocannabinolic acid, TMS. «delta»1-tetrahydrocannabinolic acid, TMS. Uridine, 2',5'-bis-O-acetyl, 3'-O-TBDMS. Quinapril Me. 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. Chanoclavine. Tryptophan-leucine, N(«alpha»,«epsilon»)-trifluoroacetyl-N-O-permethyl derivative. Moexipril Me. Formosanan-16-carboxylic acid, 19-methyl-2-oxo-, methyl ester, (19«alpha»)-. Zinc octaethylporphyrin chloride. 3'-Deoxyguanosine, tris(trimethylsilyl) deriv.. Uridine, 2'-O-acetyl, 3',5'-bis-O-TBDMS.

Find more compounds similar to 5-NITROFURFURYLIDENE DIACETATE.

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.