Chemical Properties of Nonane, 1-iodo- (CAS 4282-42-2)

InChI

InChI=1S/C9H19I/c1-2-3-4-5-6-7-8-9-10/h2-9H2,1H3

InChI Key

OGSJMFCWOUHXHN-UHFFFAOYSA-N

Formula

C9H19I

SMILES

CCCCCCCCCI

Molecular Weight¹

254.15

CAS

4282-42-2

Other Names

• 1-Iodononane
• 1-n-Nonyl iodide
• Nonyl iodide
• n-Nonyl iodide

• 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).
• Δ_vapH : Enthalpy of vaporization at a given temperature (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.
• I_p : Polar retention indices.
• T_boil : Normal Boiling Point Temperature (K).
• T_boilr : Boiling point at reduced pressure (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	0.4942		Relay (1.0) Calculated Property
ΔfG°	83.02	kJ/mol	Joback Calculated Property
ΔfH°gas	-163.77	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	23.47	kJ/mol	Joback Calculated Property
ΔvapH°	64.50	kJ/mol	NIST
IE	9.06	eV	Relay (1.0) Calculated Property
log10WS	-5.76		Relay (1.0) Calculated Property
logPoct/wat	4.172		Crippen Calculated Property
McVol	163.490	ml/mol	McGowan Calculated Property
Pc	2258.96	kPa	Joback Calculated Property
Inp	[1327.00; 1342.00]
Inp	1327.00		NIST
Inp	1342.00		NIST
Ip	[1596.00; 1621.00]
Ip	1600.00		NIST
Ip	1596.00		NIST
Ip	1621.00		NIST
Tboil	505.29	K	Relay (1.0) Calculated Property
Tc	711.13	K	Relay (1.0) Calculated Property
Tfus	253.15	K	Jean-Claude Bradley Open Melting Point Dataset (2014, CC0) Compiled value
Vc	0.626	m3/kmol	Relay (1.0) Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
ΔvapH	[53.50; 64.30]	kJ/mol	[418.00; 492.50]
ΔvapH	64.30	kJ/mol	418.00	NIST
ΔvapH	54.60	kJ/mol	471.00	NIST
ΔvapH	53.50	kJ/mol	492.50	NIST

Pressure Dependent Properties

Correlations

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[213.48; 492.82]	J/mol×K	[273.00; 1000.00]	Joback Predicted correlation
Equation			Y = A + B·T + C·T² + D·T³ + E·T⁴ Y is Cp,gas in J/mol×K, T in K
Coefficient A			6.39800e+00
Coefficient B			8.97820e-01
Coefficient C			-5.47200e-04
Coefficient D			1.35800e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	213.48	J/mol×K	273.00	Calculated Property
Cp,gas	261.55	J/mol×K	353.78	Calculated Property
Cp,gas	304.36	J/mol×K	434.56	Calculated Property
Cp,gas	342.34	J/mol×K	515.33	Calculated Property
Cp,gas	375.92	J/mol×K	596.11	Calculated Property
Cp,gas	405.52	J/mol×K	676.89	Calculated Property
Cp,gas	431.59	J/mol×K	757.67	Calculated Property
Cp,gas	454.54	J/mol×K	838.44	Calculated Property
Cp,gas	474.80	J/mol×K	919.22	Calculated Property
Cp,gas	492.82	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0054010; 0.0003110]	Pa×s	[253.15; 484.50]	Joback Predicted correlation
Equation			Y = exp(A + B/T + C·ln(T) + D·T^E) Y is η in Pa×s, T in K
Coefficient A			-1.11991e+01
Coefficient B			1.51330e+03
Coefficient C			0.00000e+00
Coefficient D			0.00000e+00
Coefficient E			0.00000e+00
Comment			Liquid phase. Joback/Reid (1987), valid from Tf to 0.7·Tc.
Temperature range, min.			253.15
Temperature range, max.			484.50
η	0.0054010	Pa×s	253.15	Calculated Property
η	0.0031128	Pa×s	278.86	Calculated Property
η	0.0019689	Pa×s	304.56	Calculated Property
η	0.0013374	Pa×s	330.27	Calculated Property
η	0.0009607	Pa×s	355.97	Calculated Property
η	0.0007215	Pa×s	381.68	Calculated Property
η	0.0005618	Pa×s	407.38	Calculated Property
η	0.0004506	Pa×s	433.09	Calculated Property
η	0.0003705	Pa×s	458.79	Calculated Property
η	0.0003110	Pa×s	484.50	Calculated Property

Property	Value	Unit	Temperature (K)	Source
Pvap	[1.33; 202.63]	kPa	[389.52; 529.93]	The Yaws Handbook of Vapor Pressure
Equation			ln(Y) = A + B/(T + C) Y is Pvap in kPa, T in K
Coefficient A			1.61999e+01
Coefficient B			-4.84249e+03
Coefficient C			-8.51960e+01
Temperature range, min.			389.52
Temperature range, max.			529.93
Pvap	1.33	kPa	389.52	Calculated Property
Pvap	2.90	kPa	405.12	Calculated Property
Pvap	5.86	kPa	420.72	Calculated Property
Pvap	11.12	kPa	436.32	Calculated Property
Pvap	19.99	kPa	451.92	Calculated Property
Pvap	34.27	kPa	467.53	Calculated Property
Pvap	56.30	kPa	483.13	Calculated Property
Pvap	89.10	kPa	498.73	Calculated Property
Pvap	136.39	kPa	514.33	Calculated Property
Pvap	202.63	kPa	529.93	Calculated Property

Similar Compounds

Find more compounds similar to Nonane, 1-iodo-.

Sources

• Jean-Claude Bradley Open Melting Point Dataset (2014, CC0) ChEDL chemicals 1.5.2, from Bradley, J.-C.; Williams, A.; Lang, A. Jean-Claude Bradley Open Melting Point Dataset. Figshare, 2014 (CC0).
• Cheméo Relay (1.0)
• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook
• The Yaws Handbook of Vapor Pressure

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