Chemical Properties of 1-Bromohexadecane (CAS 112-82-3)

1-Bromohexadecane

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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
Sources

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
logPoct/wat 6.86 Crippen Calculated Property
Pc 1387.11 kPa Joback Calculated Property
Tboil 609.20 K NIST
Tboil 463.20 K NIST
Tboil 463.00 K NIST
Tc 802.23 K Joback Calculated Property
Tfus 288.15 ± 1.50 K NIST
Vc 0.99 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 670.67 J/mol×K 631.64 Joback Calculated Property
η 0.00 Pa×s 631.64 Joback Calculated Property
ΔvapH 71.90 kJ/mol 567.0 NIST

Molecular Descriptors

Joback and Reid Groups
-CH2- 15
-CH3 1
-Br 1

Similar Compounds

1,16-Dibromohexadecane. Tetracosane, 1-bromo-. Decane, 1,10-dibromo-. NONADECANE, 1-BROMO-. 1-Bromodocosane. Tetradecane, 1-bromo-. Octane, 1,8-dibromo-. Tridecane, 1-bromo-. 1-Bromoeicosane. 1,11-Dibromoundecane. Nonane, 1-bromo-. Triacontane, 1-bromo-. Octadecane, 1-bromo-. Decane, 1-bromo-. Tetratriacontane, 1-bromo-.

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