Chemical Properties of Naphthalene, 1-(2-methylpropyl)- (CAS 16727-91-6)

InChI

InChI=1S/C14H16/c1-11(2)10-13-8-5-7-12-6-3-4-9-14(12)13/h3-9,11H,10H2,1-2H3

InChI Key

ZYFTVCJVNRKBCC-UHFFFAOYSA-N

Formula

C14H16

SMILES

CC(C)Cc1cccc2ccccc12

Molecular Weight¹

184.28

CAS

16727-91-6

Other Names

• Naphthalene, 1-isobutyl-
• «alpha»-Isobutylnaphthalene

• 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).
• 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).
• 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
ΔfG°	273.99	kJ/mol	Joback Calculated Property
ΔfH°gas	78.56	kJ/mol	Joback Calculated Property
ΔfusH°	19.16	kJ/mol	Joback Calculated Property
ΔvapH°	50.95	kJ/mol	Joback Calculated Property
log10WS	-4.67		Crippen Calculated Property
logPoct/wat	4.038		Crippen Calculated Property
McVol	164.900	ml/mol	McGowan Calculated Property
Pc	2517.59	kPa	Joback Calculated Property
Inp	[1501.00; 1501.00]
Inp	1501.00		NIST
Inp	1501.00		NIST
Tboil	552.49 ± 0.30	K	NIST
Tc	796.83	K	Joback Calculated Property
Tfus	[251.01; 263.78]	K
Tfus	263.78 ± 0.20	K	NIST
Tfus	251.01 ± 0.40	K	NIST
Vc	0.627	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[390.34; 476.91]	J/mol×K	[569.92; 796.83]
Cp,gas	390.34	J/mol×K	569.92	Joback Calculated Property
Cp,gas	407.45	J/mol×K	607.74	Joback Calculated Property
Cp,gas	423.38	J/mol×K	645.56	Joback Calculated Property
Cp,gas	438.22	J/mol×K	683.37	Joback Calculated Property
Cp,gas	452.03	J/mol×K	721.19	Joback Calculated Property
Cp,gas	464.90	J/mol×K	759.01	Joback Calculated Property
Cp,gas	476.91	J/mol×K	796.83	Joback Calculated Property
η	[0.0002631; 0.0020876]	Pa×s	[304.18; 569.92]
η	0.0020876	Pa×s	304.18	Joback Calculated Property
η	0.0011870	Pa×s	348.47	Joback Calculated Property
η	0.0007666	Pa×s	392.76	Joback Calculated Property
η	0.0005410	Pa×s	437.05	Joback Calculated Property
η	0.0004070	Pa×s	481.34	Joback Calculated Property
η	0.0003213	Pa×s	525.63	Joback Calculated Property
η	0.0002631	Pa×s	569.92	Joback Calculated Property

Similar Compounds

Find more compounds similar to Naphthalene, 1-(2-methylpropyl)-.

Sources

• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

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