Chemical Properties of Cyclohexene, 1-nitro- (CAS 2562-37-0)

InChI

InChI=1S/C6H9NO2/c8-7(9)6-4-2-1-3-5-6/h4H,1-3,5H2

InChI Key

DJBRXNRKYAWTBL-UHFFFAOYSA-N

Formula

C6H9NO2

SMILES

O=[N+]([O-])C1=CCCCC1

Molecular Weight¹

127.14

CAS

2562-37-0

Other Names

• 1-Nitrocyclohexene
• 1-Nitrocyclohex-1-ene
• 1-Nitro-1-cyclohexene

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• 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.
• I : 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
ΔfG°	87.68	kJ/mol	Joback Calculated Property
ΔfH°gas	-56.96	kJ/mol	Joback Calculated Property
ΔfusH°	14.25	kJ/mol	Joback Calculated Property
ΔvapH°	47.23	kJ/mol	Joback Calculated Property
log10WS	-2.66		Crippen Calculated Property
logPoct/wat	1.721		Crippen Calculated Property
McVol	97.660	ml/mol	McGowan Calculated Property
Pc	4311.22	kPa	Joback Calculated Property
Inp	[1174.00; 1174.00]
Inp	1174.00		NIST
Inp	1174.00		NIST
Inp	1174.00		NIST
I	[1784.00; 1784.00]
I	1784.00		NIST
I	1784.00		NIST
I	1784.00		NIST
Tboil	516.88	K	Joback Calculated Property
Tc	765.52	K	Joback Calculated Property
Tfus	325.89	K	Joback Calculated Property
Vc	0.373	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[215.00; 281.21]	J/mol×K	[516.88; 765.52]
Cp,gas	215.00	J/mol×K	516.88	Joback Calculated Property
Cp,gas	228.26	J/mol×K	558.32	Joback Calculated Property
Cp,gas	240.57	J/mol×K	599.76	Joback Calculated Property
Cp,gas	251.98	J/mol×K	641.20	Joback Calculated Property
Cp,gas	262.53	J/mol×K	682.64	Joback Calculated Property
Cp,gas	272.26	J/mol×K	724.08	Joback Calculated Property
Cp,gas	281.21	J/mol×K	765.52	Joback Calculated Property

Pressure Dependent Properties

Similar Compounds

Find more compounds similar to Cyclohexene, 1-nitro-.

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.