Chemical Properties of Oxepine, 2,7-dimethyl- (CAS 1487-99-6)

InChI

InChI=1S/C8H10O/c1-7-5-3-4-6-8(2)9-7/h3-6H,1-2H3

InChI Key

SFVUIUUSVAMYPP-UHFFFAOYSA-N

Formula

C8H10O

SMILES

CC1=CC=CC=C(C)O1

Molecular Weight¹

122.16

CAS

1487-99-6

• 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°	21.04	kJ/mol	Joback Calculated Property
ΔfH°gas	-121.55	kJ/mol	Joback Calculated Property
ΔfusH°	16.01	kJ/mol	Joback Calculated Property
ΔvapH°	41.02	kJ/mol	Joback Calculated Property
log10WS	-2.70		Crippen Calculated Property
logPoct/wat	2.380		Crippen Calculated Property
McVol	105.690	ml/mol	McGowan Calculated Property
Pc	3655.35	kPa	Joback Calculated Property
Inp	[916.70; 954.00]
Inp	916.70		NIST
Inp	916.70		NIST
Inp	934.00		NIST
Inp	954.00		NIST
Inp	916.70		NIST
Inp	934.00		NIST
Tboil	445.32	K	Joback Calculated Property
Tc	664.62	K	Joback Calculated Property
Tfus	241.91	K	Joback Calculated Property
Vc	0.389	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[202.66; 269.76]	J/mol×K	[445.32; 664.62]
Cp,gas	202.66	J/mol×K	445.32	Joback Calculated Property
Cp,gas	215.46	J/mol×K	481.87	Joback Calculated Property
Cp,gas	227.60	J/mol×K	518.42	Joback Calculated Property
Cp,gas	239.08	J/mol×K	554.97	Joback Calculated Property
Cp,gas	249.93	J/mol×K	591.52	Joback Calculated Property
Cp,gas	260.15	J/mol×K	628.07	Joback Calculated Property
Cp,gas	269.76	J/mol×K	664.62	Joback Calculated Property
η	[0.0002173; 0.0035946]	Pa×s	[241.91; 445.32]
η	0.0035946	Pa×s	241.91	Joback Calculated Property
η	0.0016893	Pa×s	275.81	Joback Calculated Property
η	0.0009366	Pa×s	309.71	Joback Calculated Property
η	0.0005834	Pa×s	343.62	Joback Calculated Property
η	0.0003956	Pa×s	377.52	Joback Calculated Property
η	0.0002860	Pa×s	411.42	Joback Calculated Property
η	0.0002173	Pa×s	445.32	Joback Calculated Property

Similar Compounds

Find more compounds similar to Oxepine, 2,7-dimethyl-.

Sources

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

Note: Cheméo is only indexing the data, follow the source links to retrieve the latest data. The source is also providing more information like the publication year, authors and more. Take the time to validate and double check the source of the data.