Chemical Properties of 1H-Benz[de]isoquinoline-1,3(2H)-dione (CAS 81-83-4)

1H-Benz[de]isoquinoline-1,3(2H)-dione

InChI
InChI=1S/C12H7NO2/c14-11-8-5-1-3-7-4-2-6-9(10(7)8)12(15)13-11/h1-6H,(H,13,14,15)
InChI Key
XJHABGPPCLHLLV-UHFFFAOYSA-N
Formula
C12H7NO2
SMILES
O=C1N=C(O)c2cccc3cccc1c23
Molecular Weight1
197.19
CAS
81-83-4
Other Names
  • 1,8-Naphthalenedicarboximide
  • 1,8-Naphthalimide
  • Naphthalimide
  • naphthalene-1,8-dicarboximide
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Physical Properties

Property Value Unit Source
ΔfH°gas -165.26 kJ/mol Relay (1.0) Calculated Property
ΔfusH° 23.75 kJ/mol Joback Calculated Property
ΔvapH° 104.46 kJ/mol Relay (1.0) Calculated Property
IE 8.68 ± 0.05 eV NIST
log10WS -3.30 Relay (1.0) Calculated Property
logPoct/wat 2.298 Crippen Calculated Property
McVol 138.980 ml/mol McGowan Calculated Property
Tfus 539.12 K Relay (1.0) Calculated Property

Cheméo can also estimate Normal Boiling Point Temperature, Critical Temperature, Critical Pressure, Critical Volume, 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.

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [384.37; 435.27] J/mol×K [759.03; 1006.80] Show Hide
Cp,gas 384.37 J/mol×K 759.03 Joback Calculated Property
Cp,gas 394.85 J/mol×K 800.32 Joback Calculated Property
Cp,gas 404.45 J/mol×K 841.62 Joback Calculated Property
Cp,gas 413.24 J/mol×K 882.91 Joback Calculated Property
Cp,gas 421.27 J/mol×K 924.21 Joback Calculated Property
Cp,gas 428.59 J/mol×K 965.50 Joback Calculated Property
Cp,gas 435.27 J/mol×K 1006.80 Joback Calculated Property

Similar Compounds

8-Carboxynaphyhalene-1-carboxamide. 5-(1'-Formyl-2'-hydroxy-3'-naphthoylamino)-2-benzimidazolone. cis-Acenaphthene-1,2-diol, ferrocenylboronate. Aflatoxin B1. Aflatoxin B2. 4-[2-(4-Allyl-2,6-dimethoxy-phenoxy)-1-hydroxy-propyl]-2-methoxy-phenol, TPS. sumatriptan, TMS. Isonipecotic acid, N-(2-fluoro-3-trifluoromethylbenzoyl)-, isohexyl ester. Inosine, 2',3',5'-tribenzoate. Dehydrocytisine. Aflatoxin G1. 9,10-Dihydrophenanthrene-cis-9,10-diol, ferrocenylboronate. Adenosine, 2'-deoxy-N-(trimethylsilyl)-3'-O-(trimethylsilyl)-, 5'-[bis(trimethylsilyl) phosphate]. 2-Methyl-1,2,3,4,9,13b-hexahydro-2,4a-diaza-tribenzo[a,c,E]cyclohepten-7-ol, acetate. 4-[2-(4-Allyl-2,6-dimethoxy-phenoxy)-1-hydroxy-propyl]-2-methoxy-phenol, TES.

Find more compounds similar to 1H-Benz[de]isoquinoline-1,3(2H)-dione.

Sources

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