Chemical Properties of Benzaldehyde, 4-nitro- (CAS 555-16-8)

Benzaldehyde, 4-nitro-

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InChI
InChI=1S/C7H5NO3/c9-5-6-1-3-7(4-2-6)8(10)11/h1-5H
InChI Key
BXRFQSNOROATLV-UHFFFAOYSA-N
Formula
C7H5NO3
SMILES
O=Cc1ccc([N+](=O)[O-])cc1
Molecular Weight1
151.12
CAS
555-16-8
Other Names
  • 4-nitrobenzaldehyde
  • Benzaldehyde, p-nitro-
  • p-Formylnitrobenzene
  • p-nitrobenzaldehyde
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Physical Properties

Property Value Unit Source
PAff 795.10 kJ/mol NIST
BasG 763.20 kJ/mol NIST
Δcsolid [-3318.00; -3316.49] kJ/mol Show Hide
Δcsolid -3318.00 kJ/mol NIST
Δcsolid -3316.49 kJ/mol NIST
EA [1.64; 1.69] eV Show Hide
EA 1.69 ± 0.09 eV NIST
EA 1.65 ± 0.09 eV NIST
EA 1.64 ± 0.09 eV NIST
Δf 46.87 kJ/mol Joback Calculated Property
Δfgas -59.09 kJ/mol Joback Calculated Property
Δfsolid [-152.70; -151.00] kJ/mol Show Hide
Δfsolid -151.00 kJ/mol NIST
Δfsolid -152.70 kJ/mol NIST
Δfus 21.19 kJ/mol Joback Calculated Property
Δvap 57.42 kJ/mol Joback Calculated Property
IE [10.27; 10.37] eV Show Hide
IE 10.27 ± 0.01 eV NIST
IE 10.27 ± 0.01 eV NIST
IE 10.37 eV NIST
log10WS -2.36 Crippen Calculated Property
logPoct/wat 1.407 Crippen Calculated Property
McVol 104.720 ml/mol McGowan Calculated Property
Pc 4516.42 kPa Joback Calculated Property
Inp [1291.80; 1302.20]   Show Hide
Inp 1291.80 NIST
Inp 1302.20 NIST
Tboil 591.72 K Joback Calculated Property
Tc 843.45 K Joback Calculated Property
Tfus [375.15; 380.35] K Show Hide
Tfus 380.35 K Thermod...
Tfus 377.15 ± 2.00 K NIST
Tfus 375.15 ± 2.50 K NIST
Tfus 380.00 ± 2.00 K NIST
Vc 0.418 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [232.64; 278.45] J/mol×K [591.72; 843.45] Show Hide
Cp,gas 232.64 J/mol×K 591.72 Joback Calculated Property
Cp,gas 242.09 J/mol×K 633.68 Joback Calculated Property
Cp,gas 250.75 J/mol×K 675.63 Joback Calculated Property
Cp,gas 258.68 J/mol×K 717.59 Joback Calculated Property
Cp,gas 265.91 J/mol×K 759.54 Joback Calculated Property
Cp,gas 272.49 J/mol×K 801.50 Joback Calculated Property
Cp,gas 278.45 J/mol×K 843.45 Joback Calculated Property

Similar Compounds

Benzene, 1-methyl-4-nitro-. 4-Nitrobenzoyl chloride. Benzaldehyde, 3-nitro-. Benzoic acid, 4-nitro-. Benzene, 1-(chloromethyl)-4-nitro-. Benzene, 1-(bromomethyl)-4-nitro-. Benzamide, 4-nitro-. Benzaldehyde, 4-nitro-, [(4-nitrophenyl)methylene]hydrazone. 4-Nitrobenzoyl isothiocyanate. 4-Nitrobenzyl thiocyanate. Acetophenone, 4'-nitro-. 2,4-Dinitrobenzaldehyde. Benzonitrile, 4-nitro-. Methanone, (4-nitrophenyl)phenyl-. Benzene, 1,1'-(1,2-ethenediyl)bis[4-nitro-, (Z)-.

Find more compounds similar to Benzaldehyde, 4-nitro-.

Mixtures

Sources

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