Chemical Properties of Naphthalene, 1-nitro- (CAS 86-57-7)

Naphthalene, 1-nitro-

PDF Excel Molecule Calculator
InChI
InChI=1S/C10H7NO2/c12-11(13)10-7-3-5-8-4-1-2-6-9(8)10/h1-7H
InChI Key
RJKGJBPXVHTNJL-UHFFFAOYSA-N
Formula
C10H7NO2
SMILES
O=[N+]([O-])c1cccc2ccccc12
Molecular Weight1
173.17
CAS
86-57-7
Other Names
  • 1-Nitronaftalen
  • 1-Nitronaphthalene
  • 1-Nitronapthalene
  • NCI-C01956
  • Nitrol
  • Nitrol (pesticide)
  • «alpha»-Nitronaphthalene
  • «alpha»-Nitronaphthalene
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
Δcsolid [-4981.26; -4978.50] kJ/mol Show Hide
Δcsolid -4978.50 kJ/mol NIST
Δcsolid -4981.26 kJ/mol NIST
EA [1.23; 1.24] eV Show Hide
EA 1.23 ± 0.10 eV NIST
EA 1.24 ± 0.05 eV NIST
Δf 278.30 kJ/mol Joback Calculated Property
Δfgas 155.64 kJ/mol Joback Calculated Property
Δfsolid 45.73 kJ/mol NIST
Δfus 23.69 kJ/mol Joback Calculated Property
Δsub 95.10 ± 0.40 kJ/mol NIST
Δvap 59.02 kJ/mol Joback Calculated Property
IE [8.59; 8.60] eV Show Hide
IE 8.59 eV NIST
IE 8.60 ± 0.01 eV NIST
log10WS [-3.59; -3.54]   Show Hide
log10WS -3.59 Aq. Sol...
log10WS -3.54 Estimat...
logPoct/wat 2.748 Crippen Calculated Property
McVol 125.960 ml/mol McGowan Calculated Property
Pc 3881.95 kPa Joback Calculated Property
Inp [266.70; 1618.00]   Show Hide
Inp 1615.66 NIST
Inp 1615.84 NIST
Inp 1597.00 NIST
Inp 1610.84 NIST
Inp 1612.87 NIST
Inp 1586.00 NIST
Inp 1589.00 NIST
Inp 1618.00 NIST
Inp 1597.00 NIST
Inp 274.40 NIST
Inp 274.18 NIST
Inp 266.70 NIST
Inp 274.07 NIST
Inp 272.40 NIST
Inp 274.95 NIST
Inp 273.00 NIST
Inp 274.00 NIST
Inp 1615.66 NIST
Inp 1618.00 NIST
Inp 1597.00 NIST
Inp 273.00 NIST
Tboil 577.20 K NIST
Tc 898.12 K Joback Calculated Property
Tfus [327.70; 332.98] K Show Hide
Tfus 332.98 K Aq. Sol...
Tfus 327.70 ± 0.40 K NIST
Tfus 329.39 ± 3.00 K NIST
Tfus 330.00 ± 1.00 K NIST
Vc 0.491 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [297.11; 353.89] J/mol×K [630.68; 898.12] Show Hide
Cp,gas 297.11 J/mol×K 630.68 Joback Calculated Property
Cp,gas 308.94 J/mol×K 675.25 Joback Calculated Property
Cp,gas 319.67 J/mol×K 719.83 Joback Calculated Property
Cp,gas 329.43 J/mol×K 764.40 Joback Calculated Property
Cp,gas 338.30 J/mol×K 808.97 Joback Calculated Property
Cp,gas 346.42 J/mol×K 853.54 Joback Calculated Property
Cp,gas 353.89 J/mol×K 898.12 Joback Calculated Property
ΔfusH [17.30; 18.43] kJ/mol [328.90; 329.90] Show Hide
ΔfusH 17.30 kJ/mol 328.90 NIST
ΔfusH 18.43 kJ/mol 329.90 NIST
ΔfusH 18.43 kJ/mol 329.90 NIST
ΔsubH [68.50; 106.90] kJ/mol [283.00; 328.50] Show Hide
ΔsubH 68.50 ± 1.90 kJ/mol 283.00 NIST
ΔsubH 94.40 ± 0.40 kJ/mol 313.00 NIST
ΔsubH 106.90 kJ/mol 328.50 NIST
ΔvapH 66.40 kJ/mol 456.00 NIST
Psub [1.73e-04; 1.13e-03] kPa [305.14; 321.14] Show Hide
Psub 1.74e-04 kPa 305.14 Thermoc...
Psub 1.74e-04 kPa 305.14 Thermoc...
Psub 1.73e-04 kPa 305.14 Thermoc...
Psub 2.25e-04 kPa 307.15 Thermoc...
Psub 2.21e-04 kPa 307.15 Thermoc...
Psub 2.18e-04 kPa 307.15 Thermoc...
Psub 2.78e-04 kPa 309.16 Thermoc...
Psub 2.81e-04 kPa 309.16 Thermoc...
Psub 2.82e-04 kPa 309.16 Thermoc...
Psub 3.52e-04 kPa 311.15 Thermoc...
Psub 3.56e-04 kPa 311.15 Thermoc...
Psub 3.53e-04 kPa 311.15 Thermoc...
Psub 4.63e-04 kPa 313.15 Thermoc...
Psub 4.53e-04 kPa 313.15 Thermoc...
Psub 4.57e-04 kPa 313.15 Thermoc...
Psub 5.80e-04 kPa 315.13 Thermoc...
Psub 5.72e-04 kPa 315.13 Thermoc...
Psub 5.74e-04 kPa 315.13 Thermoc...
Psub 6.97e-04 kPa 317.13 Thermoc...
Psub 7.02e-04 kPa 317.13 Thermoc...
Psub 6.95e-04 kPa 317.13 Thermoc...
Psub 8.75e-04 kPa 319.17 Thermoc...
Psub 8.96e-04 kPa 319.17 Thermoc...
Psub 8.80e-04 kPa 319.17 Thermoc...
Psub 1.13e-03 kPa 321.14 Thermoc...
Psub 1.11e-03 kPa 321.14 Thermoc...
Psub 1.11e-03 kPa 321.14 Thermoc...

Similar Compounds

4-Nitrophenanthrene. 1-Nitropyrene. 1,8-Dinitropyrene. 1,6-Dinitropyrene. 9-Nitrophenanthrene. 6-Nitrochrysene. Naphthalene, 1,5-dinitro-. 1,5(or 1,8)-dinitronaphthalene. Naphthalene, 1,4-dinitro-. Pyrene, 4-nitro-. 1,3-Dinitropyrene. Naphthalene, 2-nitro-. 2-Nitroanthracene. Anthracene, 9-nitro-. Phenanthrene, 2-nitro-.

Find more compounds similar to Naphthalene, 1-nitro-.

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.