Chemical Properties of Hexadecane, 1-bromo- (CAS 112-82-3)

Hexadecane, 1-bromo-

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InChI
InChI=1S/C16H33Br/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17/h2-16H2,1H3
InChI Key
HNTGIJLWHDPAFN-UHFFFAOYSA-N
Formula
C16H33Br
SMILES
CCCCCCCCCCCCCCCCBr
Molecular Weight1
305.34
CAS
112-82-3
Other Names
  • 1-Bromohexadecane
  • 1-Hexadecyl bromide
  • CETYL BROMIDE
  • Hexadecyl bromide
  • N-HEXADECYL BROMIDE
  • n-Hexadecyl-1-bromide
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Physical Properties

Property Value Unit Source
Δcliquid -10567.80 ± 1.70 kJ/mol NIST
Δf 98.16 kJ/mol Joback Calculated Property
Δfgas -350.10 ± 3.20 kJ/mol NIST
Δfliquid -444.50 ± 2.80 kJ/mol NIST
Δfus 42.48 kJ/mol Joback Calculated Property
Δvap [94.40; 94.40] kJ/mol Show Hide
Δvap 94.40 kJ/mol NIST
Δvap 94.40 ± 1.50 kJ/mol NIST
Δvap 94.40 ± 1.50 kJ/mol NIST
Δvap 94.40 ± 1.50 kJ/mol NIST
log10WS -6.95 Crippen Calculated Property
logPoct/wat 6.863 Crippen Calculated Property
McVol 253.800 ml/mol McGowan Calculated Property
Pc 1387.11 kPa Joback Calculated Property
Inp [1957.00; 1965.00]   Show Hide
Inp 1965.00 NIST
Inp 1957.00 NIST
Inp 1965.00 NIST
Inp 1957.00 NIST
I [2220.00; 2258.00]   Show Hide
I 2258.00 NIST
I 2220.00 NIST
I 2237.00 NIST
I 2237.00 NIST
I 2258.00 NIST
Tboil [463.15; 609.20] K Show Hide
Tboil 463.15 K KDB
Tboil 609.20 K NIST
Tc 802.23 K Joback Calculated Property
Tfus [287.35; 288.15] K Show Hide
Tfus 287.35 K Fabrica...
Tfus 288.15 ± 1.50 K NIST
Vc 0.994 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [670.67; 768.96] J/mol×K [631.64; 802.23] Show Hide
Cp,gas 670.67 J/mol×K 631.64 Joback Calculated Property
Cp,gas 688.95 J/mol×K 660.07 Joback Calculated Property
Cp,gas 706.44 J/mol×K 688.50 Joback Calculated Property
Cp,gas 723.15 J/mol×K 716.93 Joback Calculated Property
Cp,gas 739.12 J/mol×K 745.36 Joback Calculated Property
Cp,gas 754.38 J/mol×K 773.79 Joback Calculated Property
Cp,gas 768.96 J/mol×K 802.23 Joback Calculated Property
η [0.0001371; 0.0028764] Pa×s [329.88; 631.64] Show Hide
η 0.0028764 Pa×s 329.88 Joback Calculated Property
η 0.0012382 Pa×s 380.17 Joback Calculated Property
η 0.0006491 Pa×s 430.47 Joback Calculated Property
η 0.0003895 Pa×s 480.76 Joback Calculated Property
η 0.0002574 Pa×s 531.05 Joback Calculated Property
η 0.0001828 Pa×s 581.35 Joback Calculated Property
η 0.0001371 Pa×s 631.64 Joback Calculated Property
ΔvapH 71.90 kJ/mol 567.00 NIST

Pressure Dependent Properties

Property Value Unit Pressure (kPa) Source
Tboilr [463.00; 463.20] K [1.50; 1.50] Show Hide
Tboilr 463.20 K 1.50 NIST
Tboilr 463.00 K 1.50 NIST

Correlations

Property Value Unit Temperature (K) Source
Pvap [1.33; 202.63] kPa [467.32; 643.09] The Yaw... Show Hide
Equationln(Pvp) = A + B/(T + C)
Coefficient A1.55101e+01
Coefficient B-5.43178e+03
Coefficient C-1.10494e+02
Temperature range, min.467.32
Temperature range, max.643.09
Pvap 1.33 kPa 467.32 Calculated Property
Pvap 2.94 kPa 486.85 Calculated Property
Pvap 5.99 kPa 506.38 Calculated Property
Pvap 11.41 kPa 525.91 Calculated Property
Pvap 20.53 kPa 545.44 Calculated Property
Pvap 35.10 kPa 564.97 Calculated Property
Pvap 57.44 kPa 584.50 Calculated Property
Pvap 90.40 kPa 604.03 Calculated Property
Pvap 137.44 kPa 623.56 Calculated Property
Pvap 202.63 kPa 643.09 Calculated Property
Pvap [1.32; 331.12] kPa [461.15; 673.15] KDB Vap... Show Hide
Equationln(Pvp) = A + B/T + C*ln(T) + D*T^2
Coefficient A1.20080e+02
Coefficient B-1.45997e+04
Coefficient C-1.45223e+01
Coefficient D4.37035e-06
Temperature range, min.461.15
Temperature range, max.673.15
Pvap 1.32 kPa 461.15 Calculated Property
Pvap 3.28 kPa 484.71 Calculated Property
Pvap 7.35 kPa 508.26 Calculated Property
Pvap 15.13 kPa 531.82 Calculated Property
Pvap 28.90 kPa 555.37 Calculated Property
Pvap 51.77 kPa 578.93 Calculated Property
Pvap 87.82 kPa 602.48 Calculated Property
Pvap 142.10 kPa 626.04 Calculated Property
Pvap 220.77 kPa 649.59 Calculated Property
Pvap 331.12 kPa 673.15 Calculated Property

Similar Compounds

Pentatriacontane, 1-bromo-. Undecane, 1-bromo-. Nonane, 1-bromo-. Tetradecane, 1-bromo-. Dodecane, 1-bromo-. Tetracosane, 1-bromo-. Nonadecane, 1-bromo-. 1-Bromodocosane. Octane, 1-bromo-. 1-Bromoeicosane. Tridecane, 1-bromo-. Heptadecane, 1-bromo-. Triacontane, 1-bromo-. Pentadecane, 1-bromo-. Pentacosane, 1-bromo-.

Find more compounds similar to Hexadecane, 1-bromo-.

Sources

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