Chemical Properties of 4-Methyl-3-heptyl nitrate, diastereomer # 2

4-Methyl-3-heptyl nitrate, diastereomer # 2

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InChI
InChI=1S/C8H17NO3/c1-4-6-7(3)8(5-2)12-9(10)11/h7-8H,4-6H2,1-3H3/t7-,8-/m0/s1
InChI Key
GIQRQCALXYZGQY-YUMQZZPRSA-N
Formula
C8H17NO3
SMILES
CCCC(C)C(CC)O[N+](=O)[O-]
Molecular Weight1
175.23
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Physical Properties

Property Value Unit Source
Δf -57.85 kJ/mol Joback Calculated Property
Δfgas -361.99 kJ/mol Joback Calculated Property
Δfus 21.98 kJ/mol Joback Calculated Property
Δvap 51.63 kJ/mol Joback Calculated Property
log10WS -3.20 Crippen Calculated Property
logPoct/wat 2.410 Crippen Calculated Property
McVol 146.870 ml/mol McGowan Calculated Property
Pc 2563.69 kPa Joback Calculated Property
Inp [1096.00; 1096.00]   Show Hide
Inp 1096.00 NIST
Inp 1096.00 NIST
Tboil 555.82 K Joback Calculated Property
Tc 758.71 K Joback Calculated Property
Tfus 315.76 K Joback Calculated Property
Vc 0.572 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [363.71; 438.40] J/mol×K [555.82; 758.71] Show Hide
Cp,gas 363.71 J/mol×K 555.82 Joback Calculated Property
Cp,gas 377.84 J/mol×K 589.63 Joback Calculated Property
Cp,gas 391.28 J/mol×K 623.45 Joback Calculated Property
Cp,gas 404.05 J/mol×K 657.26 Joback Calculated Property
Cp,gas 416.15 J/mol×K 691.08 Joback Calculated Property
Cp,gas 427.60 J/mol×K 724.89 Joback Calculated Property
Cp,gas 438.40 J/mol×K 758.71 Joback Calculated Property

Similar Compounds

4-Methyl-3-heptyl nitrate, diastereomer # 1. 2-Methyl-3-hexyl nitrate. 2-Methyl-4-heptyl nitrate. 2-Methyl-6-heptyl nitrate. 3-Methyl-2-pentyl nitrate, diastereomer # 2. 3-Methyl-2-pentyl nitrate, diastereomer # 1. 2-Methyl-5-hexyl nitrate. 3-Heptyl nitrate. 3-Undecyl nitrate. 3-Nonyl nitrate. 3-Octyl nitrate. 5-Nonyl nitrate. 6-Undecyl nitrate. 4-Octyl nitrate. 4-Decyl nitrate.

Find more compounds similar to 4-Methyl-3-heptyl nitrate, diastereomer # 2.

Sources

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