Chemical Properties of Heptane, 3-(bromomethyl)- (CAS 18908-66-2)

Heptane, 3-(bromomethyl)-

InChI
InChI=1S/C8H17Br/c1-3-5-6-8(4-2)7-9/h8H,3-7H2,1-2H3
InChI Key
NZWIYPLSXWYKLH-UHFFFAOYSA-N
Formula
C8H17Br
SMILES
CCCCC(CC)CBr
Molecular Weight1
193.12
CAS
18908-66-2
Other Names
  • 1-Bromo-2-ethylhexane
  • 2-Ethylhexyl bromide
  • 3-(Bromomethyl)heptane
  • Hexane, 1-bromo-2-ethyl
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Physical Properties

Property Value Unit Source
ω 0.4633 Relay (1.0) Calculated Property
ΔfG° 28.36 kJ/mol Joback Calculated Property
ΔfH°gas -207.13 kJ/mol Relay (1.0) Calculated Property
ΔfusH° 18.24 kJ/mol Joback Calculated Property
ΔvapH° 50.92 kJ/mol Relay (1.0) Calculated Property
IE 9.62 eV Relay (1.0) Calculated Property
log10WS -4.79 Relay (1.0) Calculated Property
logPoct/wat 3.598 Crippen Calculated Property
McVol 141.080 ml/mol McGowan Calculated Property
Pc 2744.03 kPa Joback Calculated Property
Tboil 457.71 K Relay (1.0) Calculated Property
Tc 637.73 K Relay (1.0) Calculated Property
Tfus 191.18 K Relay (1.0) Calculated Property
Vc 0.500 m3/kmol Relay (1.0) Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [277.18; 348.69] J/mol×K [448.16; 633.14] Show Hide
Cp,gas 277.18 J/mol×K 448.16 Joback Calculated Property
Cp,gas 290.54 J/mol×K 478.99 Joback Calculated Property
Cp,gas 303.29 J/mol×K 509.82 Joback Calculated Property
Cp,gas 315.46 J/mol×K 540.65 Joback Calculated Property
Cp,gas 327.07 J/mol×K 571.48 Joback Calculated Property
Cp,gas 338.14 J/mol×K 602.31 Joback Calculated Property
Cp,gas 348.69 J/mol×K 633.14 Joback Calculated Property
η [0.0002948; 0.0063866] Pa×s [224.72; 448.16] Show Hide
η 0.0063866 Pa×s 224.72 Joback Calculated Property
η 0.0026570 Pa×s 261.96 Joback Calculated Property
η 0.0013751 Pa×s 299.20 Joback Calculated Property
η 0.0008234 Pa×s 336.44 Joback Calculated Property
η 0.0005461 Pa×s 373.68 Joback Calculated Property
η 0.0003902 Pa×s 410.92 Joback Calculated Property
η 0.0002948 Pa×s 448.16 Joback Calculated Property

Pressure Dependent Properties

Property Value Unit Pressure (kPa) Source
Tboilr 349.20 K 2.10 NIST

Correlations

Property Value Unit Temperature (K) Source
Pvap [1.33; 202.67] kPa [346.36; 494.12] The Yaws Handbook of Vapor Pressure Show Hide
Equationln(Pvp) = A + B/(T + C)
Coefficient A1.47604e+01
Coefficient B-4.02200e+03
Coefficient C-6.84600e+01
Temperature range, min.346.36
Temperature range, max.494.12
Pvap 1.33 kPa 346.36 Calculated Property
Pvap 2.99 kPa 362.78 Calculated Property
Pvap 6.15 kPa 379.20 Calculated Property
Pvap 11.78 kPa 395.61 Calculated Property
Pvap 21.20 kPa 412.03 Calculated Property
Pvap 36.16 kPa 428.45 Calculated Property
Pvap 58.86 kPa 444.87 Calculated Property
Pvap 92.00 kPa 461.28 Calculated Property
Pvap 138.73 kPa 477.70 Calculated Property
Pvap 202.67 kPa 494.12 Calculated Property

Similar Compounds

Cyclohexane, (bromomethyl)-. 1,3,5-tris-(Bromomethyl) cyclohexane. 1-Bromo-2-methylpentane. 1-Bromo-6-methyloctane. 1-Bromo-3,7-dimethyloctane. Pentane, 3-(bromomethyl)-. 1-Bromo-4-methylhexane. Heptane, 1-bromo-6-methyl-. Cyclohexane, (2-bromoethyl)-. 1-Bromo-5-methylhexane. 1-Bromo-3,5,5-trimethylhexane. Cyclohexane, 1-bromo-3-methyl-. 1-bromomethyladamantane. Cyclohexane, 1-bromo-4-methyl-. Tricyclo[3.3.1.13,7]decane, 2-bromo-.

Find more compounds similar to Heptane, 3-(bromomethyl)-.

Sources

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