Chemical Properties of Cyclohexene (CAS 110-83-8)

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InChI

InChI=1S/C6H10/c1-2-4-6-5-3-1/h1-2H,3-6H2

InChI Key

HGCIXCUEYOPUTN-UHFFFAOYSA-N

Formula

C6H10

SMILES

C1=CCCCC1

Molecular Weight¹

82.14

CAS

110-83-8

Other Names

• 1,2,3,4-Tetrahydrobenzene
• 1-Cyclohexene
• Benzene tetrahydride
• Benzene, tetrahydro-
• Cyclohex-1-ene
• Cykloheksen
• Hexanaphthylene
• NSC 24835
• Tetrahydrobenzene
• UN 2256

Sources

• Joback Method
• NIST Webbook
• Crippen Method

• PAff: Proton affinity (kJ/mol).
• BasG: Gas basicity (kJ/mol).
• Δ_cH°_liquid: Standard liquid enthalpy of combustion (kJ/mol).
• C_p,gas: Ideal gas heat capacity (J/mol×K).
• C_p,liquid: Liquid phase 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_fH°_liquid: Liquid phase enthalpy of formation at standard conditions (kJ/mol).
• Δ_fusH°: Enthalpy of fusion at standard conditions (kJ/mol).
• Δ_fusH: Enthalpy of fusion at a given temperature (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).
• logP_oct/wat: Octanol/Water partition coefficient.
• P_c: Critical Pressure (kPa).
• Δ_fusS: Entropy of fusion at a given temperature (J/mol×K).
• S°_gas: Molar entropy at standard conditions (J/mol×K).
• S°_liquid: Liquid phase molar entropy at standard conditions (J/mol×K).
• T_boil: Normal Boiling Point Temperature (K).
• T_c: Critical Temperature (K).
• T_fus: Normal melting (fusion) point (K).
• T_triple: Triple Point Temperature (K).
• V_c: Critical Volume (m³/kg-mol).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
PAff	784.50	kJ/mol	NIST
BasG	752.00	kJ/mol	NIST
ΔcH°liquid	[-3761.00; -3751.50]	kJ/mol
ΔcH°liquid	-3752.39 ± 0.49	kJ/mol	NIST
ΔcH°liquid	-3752.00 ± 0.50	kJ/mol	NIST
ΔcH°liquid	-3751.50 ± 0.50	kJ/mol	NIST
ΔcH°liquid	-3761.00	kJ/mol	NIST
ΔfG°	61.76	kJ/mol	Joback Calculated Property
ΔfH°gas	[-7.10; -4.32]	kJ/mol
ΔfH°gas	-4.32 ± 0.98	kJ/mol	NIST
ΔfH°gas	-4.70	kJ/mol	NIST
ΔfH°gas	-5.30	kJ/mol	NIST
ΔfH°gas	-7.10	kJ/mol	NIST
ΔfH°liquid	[-40.60; -37.80]	kJ/mol
ΔfH°liquid	-37.80 ± 8.20	kJ/mol	NIST
ΔfH°liquid	-38.20 ± 0.59	kJ/mol	NIST
ΔfH°liquid	-38.80 ± 0.59	kJ/mol	NIST
ΔfH°liquid	-40.60 ± 0.79	kJ/mol	NIST
ΔfusH°	3.28	kJ/mol	Joback Calculated Property
ΔvapH°	[30.50; 33.57]	kJ/mol
ΔvapH°	33.57	kJ/mol	NIST
ΔvapH°	33.50 ± 0.53	kJ/mol	NIST
ΔvapH°	33.50	kJ/mol	NIST
ΔvapH°	33.50 ± 0.50	kJ/mol	NIST
ΔvapH°	30.50 ± 0.30	kJ/mol	NIST
IE	[8.92; 9.57]	eV
IE	8.95 ± 0.01	eV	NIST
IE	8.94	eV	NIST
IE	8.94 ± 0.02	eV	NIST
IE	8.95	eV	NIST
IE	8.94 ± 0.01	eV	NIST
IE	Outlier 9.57 ± 0.05	eV	NIST
IE	8.99	eV	NIST
IE	8.92	eV	NIST
IE	8.95 ± 0.01	eV	NIST
IE	8.94	eV	NIST
IE	8.92 ± 0.02	eV	NIST
IE	8.95 ± 0.01	eV	NIST
IE	9.09	eV	NIST
IE	9.12	eV	NIST
IE	9.12	eV	NIST
IE	9.12	eV	NIST
IE	9.11	eV	NIST
logPoct/wat	2.117		Crippen Calculated Property
Pc	4328.25	kPa	Joback Calculated Property
S°gas	310.45	J/mol×K	NIST
S°liquid	214.60	J/mol×K	NIST
S°liquid	216.19	J/mol×K	NIST
S°liquid	216.70	J/mol×K	NIST
Tboil	[353.00; 358.00]	K
Tboil	356.15 ± 0.10	K	NIST
Tboil	356.20	K	NIST
Tboil	355.50 ± 0.50	K	NIST
Tboil	356.20	K	NIST
Tboil	356.16 ± 0.20	K	NIST
Tboil	356.00 ± 1.00	K	NIST
Tboil	356.15 ± 0.40	K	NIST
Tboil	356.30 ± 0.40	K	NIST
Tboil	354.15 ± 2.00	K	NIST
Tboil	356.30 ± 0.30	K	NIST
Tboil	356.13 ± 0.30	K	NIST
Tboil	Outlier 354.00 ± 5.00	K	NIST
Tboil	355.90 ± 2.00	K	NIST
Tboil	356.15 ± 0.10	K	NIST
Tboil	Outlier 354.00 ± 3.00	K	NIST
Tboil	356.90 ± 1.00	K	NIST
Tboil	Outlier 353.00 ± 4.00	K	NIST
Tboil	355.00 ± 5.00	K	NIST
Tboil	357.00 ± 4.00	K	NIST
Tboil	356.15 ± 0.30	K	NIST
Tboil	355.70 ± 0.50	K	NIST
Tboil	355.65 ± 1.00	K	NIST
Tboil	Outlier 354.00 ± 5.00	K	NIST
Tboil	356.20 ± 0.40	K	NIST
Tboil	356.10 ± 0.50	K	NIST
Tboil	356.20 ± 0.60	K	NIST
Tboil	355.00 ± 2.00	K	NIST
Tboil	356.15 ± 1.00	K	NIST
Tboil	356.12 ± 0.10	K	NIST
Tboil	355.00 ± 2.00	K	NIST
Tboil	356.40 ± 1.00	K	NIST
Tboil	355.90 ± 0.40	K	NIST
Tboil	355.50 ± 0.50	K	NIST
Tboil	357.00 ± 4.00	K	NIST
Tboil	356.00 ± 0.60	K	NIST
Tboil	356.34 ± 0.20	K	NIST
Tboil	355.30 ± 0.40	K	NIST
Tboil	357.00 ± 3.00	K	NIST
Tboil	355.85 ± 0.50	K	NIST
Tboil	357.00 ± 2.00	K	NIST
Tboil	355.85 ± 0.15	K	NIST
Tboil	356.30 ± 0.60	K	NIST
Tboil	357.00 ± 3.00	K	NIST
Tboil	Outlier 358.00 ± 3.00	K	NIST
Tboil	355.80 ± 0.30	K	NIST
Tboil	357.00 ± 3.00	K	NIST
Tboil	356.70 ± 2.00	K	NIST
Tboil	Outlier 354.00 ± 3.00	K	NIST
Tboil	356.40 ± 0.20	K	NIST
Tboil	357.00 ± 4.00	K	NIST
Tboil	356.40 ± 2.00	K	NIST
Tboil	356.00 ± 3.00	K	NIST
Tboil	Outlier 354.00 ± 4.00	K	NIST
Tboil	356.00 ± 3.00	K	NIST
Tboil	356.45 ± 1.00	K	NIST
Tboil	357.00 ± 2.00	K	NIST
Tboil	355.50 ± 2.00	K	NIST
Tc	[553.50; 560.42]	K
Tc	560.40 ± 0.10	K	NIST
Tc	560.40	K	NIST
Tc	560.40 ± 0.30	K	NIST
Tc	560.42 ± 0.02	K	NIST
Tc	553.50 ± 0.15	K	NIST
Tfus	[168.00; 169.80]	K
Tfus	169.64 ± 0.06	K	NIST
Tfus	169.45 ± 0.50	K	NIST
Tfus	169.49 ± 0.20	K	NIST
Tfus	Outlier 168.00 ± 3.00	K	NIST
Tfus	169.80 ± 0.30	K	NIST
Tfus	169.00 ± 1.50	K	NIST
Tfus	169.05 ± 0.20	K	NIST
Tfus	169.10 ± 1.00	K	NIST
Tfus	169.00 ± 0.30	K	NIST
Ttriple	169.66 ± 0.02	K	NIST
Ttriple	169.67 ± 0.05	K	NIST
Ttriple	169.00 ± 0.20	K	NIST
Vc	0.291	m3/kg-mol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	133.47	J/mol×K	370.0	NIST
Cp,gas	141.42	J/mol×K	390.0	NIST
Cp,gas	148.53	J/mol×K	410.0	NIST
Cp,liquid	[145.60; 152.90]	J/mol×K	[293.20; 298.15]
Cp,liquid	145.60	J/mol×K	293.2	NIST
Cp,liquid	152.90	J/mol×K	298.12	NIST
Cp,liquid	148.80	J/mol×K	298.15	NIST
Cp,liquid	148.35	J/mol×K	298.15	NIST
Cp,liquid	149.16	J/mol×K	298.15	NIST
η	0.0002769	Pa×s	360.06	Joback Calculated Property
ΔfusH	4.23	kJ/mol	138.7	NIST
ΔfusH	3.28	kJ/mol	169.7	NIST
ΔvapH	[30.46; 33.70]	kJ/mol	[260.50; 356.20]
ΔvapH	32.60	kJ/mol	260.5	NIST
ΔvapH	32.59	kJ/mol	300.0	NIST
ΔvapH	32.70 ± 0.10	kJ/mol	313.0	NIST
ΔvapH	33.10	kJ/mol	313.5	NIST
ΔvapH	33.70	kJ/mol	321.0	NIST
ΔvapH	32.20 ± 0.10	kJ/mol	323.0	NIST
ΔvapH	32.90	kJ/mol	333.0	NIST
ΔvapH	31.70 ± 0.10	kJ/mol	333.0	NIST
ΔvapH	32.60	kJ/mol	334.0	NIST
ΔvapH	32.80	kJ/mol	335.5	NIST
ΔvapH	32.70	kJ/mol	337.0	NIST
ΔvapH	31.20 ± 0.10	kJ/mol	343.0	NIST
ΔvapH	30.70 ± 0.10	kJ/mol	353.0	NIST
ΔvapH	30.46	kJ/mol	356.2	NIST
ΔfusS	30.50	J/mol×K	138.7	NIST
ΔfusS	19.35	J/mol×K	169.7	NIST

Molecular Descriptors

Joback and Reid Groups
-CH2- (ring)	4
=CH- (ring)	2

Similar Compounds

Find more compounds similar to Cyclohexene.

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