Chemical Properties of Tridecane, 2-bromo- (CAS 59157-17-4)

InChI

InChI=1S/C13H27Br/c1-3-4-5-6-7-8-9-10-11-12-13(2)14/h13H,3-12H2,1-2H3

InChI Key

XNCUZDYTCKIDEJ-UHFFFAOYSA-N

Formula

C13H27Br

SMILES

CCCCCCCCCCCC(C)Br

Molecular Weight¹

263.26

CAS

59157-17-4

Other Names

• 2-Bromotridecane

• ω : Acentric Factor.
• C_p,gas : Ideal gas heat capacity (J/mol×K).
• η : Dynamic viscosity (Pa×s).
• Δ_fG° : Standard Gibbs free energy of formation (kJ/mol).
• Δ_fH°_gas : Enthalpy of formation at standard conditions (kJ/mol).
• Δ_fusH° : Enthalpy of fusion at standard conditions (kJ/mol).
• Δ_vapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
• IE : Ionization energy (eV).
• log₁₀WS : Log10 of Water solubility in mol/l.
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• P_c : Critical Pressure (kPa).
• P_vap : Vapor pressure (kPa).
• I_np : Non-polar retention indices.
• T_boil : Normal Boiling Point Temperature (K).
• T_c : Critical Temperature (K).
• T_fus : Normal melting (fusion) point (K).
• V_c : Critical Volume (m³/kmol).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
ω	0.6656		Relay (1.0) Calculated Property
ΔfG°	70.46	kJ/mol	Joback Calculated Property
ΔfH°gas	-311.31	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	31.19	kJ/mol	Joback Calculated Property
ΔvapH°	72.77	kJ/mol	Relay (1.0) Calculated Property
IE	9.83	eV	Relay (1.0) Calculated Property
log10WS	-6.76		Relay (1.0) Calculated Property
logPoct/wat	5.691		Crippen Calculated Property
McVol	211.530	ml/mol	McGowan Calculated Property
Pc	1752.14	kPa	Joback Calculated Property
Inp	[1609.00; 1609.00]
Inp	1609.00		NIST
Inp	1609.00		NIST
Tboil	550.54	K	Relay (1.0) Calculated Property
Tc	724.65	K	Relay (1.0) Calculated Property
Tfus	273.09	K	Relay (1.0) Calculated Property
Vc	0.817	m3/kmol	Relay (1.0) Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[510.95; 603.16]	J/mol×K	[562.56; 738.95]
Cp,gas	510.95	J/mol×K	562.56	Joback Calculated Property
Cp,gas	528.15	J/mol×K	591.96	Joback Calculated Property
Cp,gas	544.58	J/mol×K	621.36	Joback Calculated Property
Cp,gas	560.27	J/mol×K	650.75	Joback Calculated Property
Cp,gas	575.24	J/mol×K	680.15	Joback Calculated Property
Cp,gas	589.53	J/mol×K	709.55	Joback Calculated Property
Cp,gas	603.16	J/mol×K	738.95	Joback Calculated Property
η	[0.0001829; 0.0049890]	Pa×s	[281.07; 562.56]
η	0.0049890	Pa×s	281.07	Joback Calculated Property
η	0.0019389	Pa×s	327.99	Joback Calculated Property
η	0.0009546	Pa×s	374.90	Joback Calculated Property
η	0.0005502	Pa×s	421.81	Joback Calculated Property
η	0.0003541	Pa×s	468.73	Joback Calculated Property
η	0.0002470	Pa×s	515.64	Joback Calculated Property
η	0.0001829	Pa×s	562.56	Joback Calculated Property

Correlations

Property	Value	Unit	Temperature (K)	Source
Pvap	[1.33; 202.67]	kPa	[424.12; 592.26]	The Yaws Handbook of Vapor Pressure
Equation			ln(Pvp) = A + B/(T + C)
Coefficient A			1.51312e+01
Coefficient B			-4.87818e+03
Coefficient C			-9.54820e+01
Temperature range, min.			424.12
Temperature range, max.			592.26
Pvap	1.33	kPa	424.12	Calculated Property
Pvap	2.96	kPa	442.80	Calculated Property
Pvap	6.07	kPa	461.48	Calculated Property
Pvap	11.59	kPa	480.17	Calculated Property
Pvap	20.85	kPa	498.85	Calculated Property
Pvap	35.62	kPa	517.53	Calculated Property
Pvap	58.14	kPa	536.21	Calculated Property
Pvap	91.19	kPa	554.90	Calculated Property
Pvap	138.08	kPa	573.58	Calculated Property
Pvap	202.67	kPa	592.26	Calculated Property

Similar Compounds

Find more compounds similar to Tridecane, 2-bromo-.

Sources

• Cheméo Relay (1.0)
• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook
• The Yaws Handbook of Vapor Pressure

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