Chemical Properties of Pentanoic acid, 4-methyl-4-nitro-, methyl ester

Pentanoic acid, 4-methyl-4-nitro-, methyl ester

InChI
InChI=1S/C7H13NO4/c1-7(2,8(10)11)5-4-6(9)12-3/h4-5H2,1-3H3
InChI Key
MROVMGGCWUQHMR-UHFFFAOYSA-N
Formula
C7H13NO4
SMILES
COC(=O)CCC(C)(C)[N+](=O)[O-]
Molecular Weight1
175.18
Other Names
  • Valeric acid, 4-methyl-4-nitro-, methyl ester
  • Methyl 4-methyl-4-nitropentanoate
  • Methyl 4-nitro-4-valerate
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Physical Properties

Property Value Unit Source
ω 0.5110 Relay (1.0) Calculated Property
ΔfH°gas -497.12 kJ/mol Relay (1.0) Calculated Property
ΔfusH° 22.20 kJ/mol Joback Calculated Property
ΔvapH° 69.62 kJ/mol Relay (1.0) Calculated Property
IE 10.03 eV Relay (1.0) Calculated Property
log10WS -1.86 Relay (1.0) Calculated Property
logPoct/wat 0.995 Crippen Calculated Property
McVol 134.350 ml/mol McGowan Calculated Property
Pc 2909.25 kPa Joback Calculated Property
Tboil 482.96 K Relay (1.0) Calculated Property
Tc 692.78 K Relay (1.0) Calculated Property
Tfus 291.00 K Relay (1.0) Calculated Property
Vc 0.483 m3/kmol Relay (1.0) Calculated Property

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Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [333.30; 396.80] J/mol×K [566.59; 782.10] Show Hide
Cp,gas 333.30 J/mol×K 566.59 Joback Calculated Property
Cp,gas 345.84 J/mol×K 602.51 Joback Calculated Property
Cp,gas 357.57 J/mol×K 638.43 Joback Calculated Property
Cp,gas 368.49 J/mol×K 674.34 Joback Calculated Property
Cp,gas 378.66 J/mol×K 710.26 Joback Calculated Property
Cp,gas 388.08 J/mol×K 746.18 Joback Calculated Property
Cp,gas 396.80 J/mol×K 782.10 Joback Calculated Property

Similar Compounds

Hexanedioic acid, 3-methyl-, dimethyl ester. Heptanedioic acid, 4-methyl-, dimethyl ester. Hexanoic acid, 4-methyl-, methyl ester. Pentane, 2,4-dimethyl-2-nitro-. Butanoic acid, 4-nitro-, methyl ester. Tricyclo[3.3.1.1(3,7)]decane, 1-nitro-. Cholan-24-oic acid, 3-oxo-, methyl ester, (5«beta»)-. 4-Methylheptanoic acid, methyl ester. Pentanoic acid, 4-methyl-, methyl ester. 3-Cyclopentylpropionic acid, methyl ester. Glutaric acid, monoamide, N-(1-adamantyl)-, ethyl ester. Adipic acid, isohexyl pent-4-enyl ester. Octadecanoic acid, 4-methyl-, methyl ester. Octanoic acid, 4-methyl-, methyl ester. 4-Methyldecanoic acid, methyl ester.

Find more compounds similar to Pentanoic acid, 4-methyl-4-nitro-, methyl ester.

Sources

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