Chemical Properties of Pentane, 1-bromo- (CAS 110-53-2)

Pentane, 1-bromo-

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InChI
InChI=1S/C5H11Br/c1-2-3-4-5-6/h2-5H2,1H3
InChI Key
YZWKKMVJZFACSU-UHFFFAOYSA-N
Formula
C5H11Br
SMILES
CCCCCBr
Molecular Weight1
151.04
CAS
110-53-2
Other Names
  • 1-Bromopentane
  • 1-Pentyl bromide
  • Amyl bromide
  • Pentyl bromide
  • n-Amyl bromide
  • n-C5H11Br
  • n-Pentyl bromide
Sources

Physical Properties

Property Value Unit Source
Δcliquid -3369.40 ± 1.40 kJ/mol NIST
Δf 5.54 kJ/mol Joback Calculated Property
Δfgas -129.80 ± 1.90 kJ/mol NIST
Δfliquid -170.40 ± 1.50 kJ/mol NIST
Δfus 13.99 kJ/mol Joback Calculated Property
Δvap [40.90; 41.43] kJ/mol Show Hide
Δvap 41.31 kJ/mol NIST
Δvap 40.90 kJ/mol NIST
Δvap 41.40 ± 0.10 kJ/mol NIST
Δvap 41.43 ± 0.02 kJ/mol NIST
Δvap 41.10 ± 0.10 kJ/mol NIST
Δvap 41.10 ± 0.10 kJ/mol NIST
IE [10.01; 10.10] eV Show Hide
IE 10.10 ± 0.01 eV NIST
IE 10.01 eV NIST
IE 10.09 eV NIST
IE 10.10 ± 0.02 eV NIST
logPoct/wat 2.57 Crippen Calculated Property
Pc 3768.41 kPa Joback Calculated Property
liquid 406.77 J/mol×K NIST
Tboil [294.20; 403.00] K Show Hide
Tboil Outlier 294.20 K NIST
Tboil 403.00 K NIST
Tboil 402.80 K NIST
Tboil 402.90 K NIST
Tboil 402.00 ± 0.40 K NIST
Tboil 402.70 ± 0.40 K NIST
Tboil 402.73 ± 0.15 K NIST
Tboil 391.40 ± 0.50 K NIST
Tboil 391.10 ± 0.60 K NIST
Tboil 391.80 ± 1.50 K NIST
Tc 564.76 K Joback Calculated Property
Tfus [178.48; 185.20] K Show Hide
Tfus 185.20 ± 0.20 K NIST
Tfus 184.80 ± 5.00 K NIST
Tfus 178.48 ± 0.20 K NIST
Tfus 185.10 ± 0.20 K NIST
Vc 0.38 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 161.36 J/mol×K 379.96 Joback Calculated Property
Cp,liquid 174.90 J/mol×K 206.6 NIST
Cp,liquid 171.59 J/mol×K 290.7 NIST
Cp,liquid 219.70 J/mol×K 298.15 NIST
η 0.00 Pa×s 379.96 Joback Calculated Property
ΔfusH [11.47; 14.37] kJ/mol [185.10; 185.10] Show Hide
ΔfusH 11.46 kJ/mol 185.1 NIST
ΔfusH 14.37 kJ/mol 185.1 NIST
ΔfusH 14.37 kJ/mol 185.1 NIST
ΔfusH 14.36 kJ/mol 185.1 NIST
ΔvapH 41.00 kJ/mol 368.0 NIST
ΔvapH 35.01 kJ/mol 402.9 NIST
ΔfusS 62.00 J/mol×K 185.1 NIST
ΔfusS 77.61 J/mol×K 185.1 NIST
ΔfusS 77.60 J/mol×K 185.1 NIST

Molecular Descriptors

Joback and Reid Groups
-CH2- 4
-CH3 1
-Br 1

Similar Compounds

Pentane, 1,5-dibromo-. Hexane, 1-bromo-. Butane, 1-bromo-. Hexane, 1,6-dibromo-. Butane, 1,4-dibromo-. Heptane, 1-bromo-. Pentane, 1-bromo-4-methyl-. Heptane, 1,7-dibromo-. Hexane, 2-bromo-. Pentane, 2-bromo-. 1-Bromoeicosane. Dodecane, 1-bromo-. NONADECANE, 1-BROMO-. Heptadecane, 1-bromo-. Pentadecane, 1-bromo-.

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Outlier This icon means that the value is more than 2 standard deviations away from the property mean.