Chemical Properties of Hexane, 1-nitro- (CAS 646-14-0)

Hexane, 1-nitro-

PDF Excel Molecule Calculator
InChI
InChI=1S/C6H13NO2/c1-2-3-4-5-6-7(8)9/h2-6H2,1H3
InChI Key
FEYJIFXFOHFGCC-UHFFFAOYSA-N
Formula
C6H13NO2
SMILES
CCCCCC[N+](=O)[O-]
Molecular Weight1
131.17
CAS
646-14-0
Other Names
  • 1-Nitrohexane
  • Nitrohexane
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
Δf 35.19 kJ/mol Joback Calculated Property
Δfgas -177.93 kJ/mol Joback Calculated Property
Δfus 22.66 kJ/mol Joback Calculated Property
Δvap 45.54 kJ/mol Joback Calculated Property
log10WS -2.42 Crippen Calculated Property
logPoct/wat 1.843 Crippen Calculated Property
McVol 112.820 ml/mol McGowan Calculated Property
Pc 3149.09 kPa Joback Calculated Property
Inp [1004.40; 1050.00]   Show Hide
Inp 1050.00 NIST
Inp 1011.70 NIST
Inp 1004.40 NIST
Inp 1009.70 NIST
Inp 1008.00 NIST
Tboil 488.52 K Joback Calculated Property
Tc 690.22 K Joback Calculated Property
Tfus 300.99 K Joback Calculated Property
Vc 0.454 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [250.19; 312.36] J/mol×K [488.52; 690.22] Show Hide
Cp,gas 250.19 J/mol×K 488.52 Joback Calculated Property
Cp,gas 261.93 J/mol×K 522.14 Joback Calculated Property
Cp,gas 273.10 J/mol×K 555.75 Joback Calculated Property
Cp,gas 283.71 J/mol×K 589.37 Joback Calculated Property
Cp,gas 293.78 J/mol×K 622.99 Joback Calculated Property
Cp,gas 303.32 J/mol×K 656.60 Joback Calculated Property
Cp,gas 312.36 J/mol×K 690.22 Joback Calculated Property

Correlations

Property Value Unit Temperature (K) Source
Pvap [1.33; 202.65] kPa [350.32; 493.56] The Yaw... Show Hide
Equationln(Pvp) = A + B/(T + C)
Coefficient A1.51124e+01
Coefficient B-4.14267e+03
Coefficient C-7.08790e+01
Temperature range, min.350.32
Temperature range, max.493.56
Pvap 1.33 kPa 350.32 Calculated Property
Pvap 2.96 kPa 366.24 Calculated Property
Pvap 6.07 kPa 382.15 Calculated Property
Pvap 11.60 kPa 398.07 Calculated Property
Pvap 20.87 kPa 413.98 Calculated Property
Pvap 35.64 kPa 429.90 Calculated Property
Pvap 58.17 kPa 445.81 Calculated Property
Pvap 91.22 kPa 461.73 Calculated Property
Pvap 138.11 kPa 477.64 Calculated Property
Pvap 202.65 kPa 493.56 Calculated Property

Similar Compounds

Heptane, 1-nitro-. Nitropentadecane. Nitrotridecane. 1-Nitro octane. 1-Nitro decane. 1-Nitrododecane. Pentane, 1-nitro-. Butane, 1-nitro-. Hexane, 2-nitro-. Cyclohexane, nitro-. 1-nitro-3-methylbutane. Pentane, 2-nitro-. Cyclopentane, nitro-. 1-Azidohexane. Cyclohexanone, 2-nitro-.

Find more compounds similar to Hexane, 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.