Chemical Properties of (E)-Stilbene (CAS 103-30-0)

InChI

InChI=1S/C14H12/c1-3-7-13(8-4-1)11-12-14-9-5-2-6-10-14/h1-12H/b12-11+

InChI Key

PJANXHGTPQOBST-VAWYXSNFSA-N

Formula

C14H12

SMILES

C(=Cc1ccccc1)c1ccccc1

Molecular Weight¹

180.25

CAS

103-30-0

Other Names

• (1,2-Ethenediyl)-1,1'-bisbenzene, (E)-
• (E)-1,2-DIPHENYLETHYLENE
• (E)-1,2-Diphenylethene
• 1,1'-(1,2-Ethanediyl)bis(benzene), (E)-
• 1,1'-(1,2-Ethanediyl)bis[benzene], trans
• 1,2-Diphenylethene, (E)-
• 1,2-Diphenylethylene (trans)
• 1,trans-2-Diphenylethene
• 1,trans-2-Diphenylethylene
• Benzene, 1,1'-(1,2-ethenediyl)bis-, (E)-
• Benzene, 1,1'-(1E)-1,2-ethenediylbis-
• Dibenzal, (E)-
• Dibenzylidne, (E)-
• NSC 2069
• Stilbene (trans)
• Stilbene, (E)-
• TRANS-1,2-DIPHENYLETHTNE
• TRANS-STILBENE
• Toluylene
• t-Stilbene
• trans-1,2-Diphenylethene
• trans-1,2-Diphenylethylene
• trans-Bibenzal
• trans-Bibenzylidene
• trans-Diphenylethene
• trans-«alpha»,«beta»-Diphenylethylene
• trans-«alpha»,«beta»-Diphenylethylene

• Δ_cH°_liquid : Standard liquid enthalpy of combustion (kJ/mol).
• Δ_cH°_solid : Standard solid enthalpy of combustion (kJ/mol).
• C_p,gas : Ideal gas heat capacity (J/mol×K).
• C_p,solid : Solid phase heat capacity (J/mol×K).
• η : Dynamic viscosity (Pa×s).
• EA : Electron affinity (eV).
• Δ_fG° : Standard Gibbs free energy of formation (kJ/mol).
• Δ_fH°_gas : Enthalpy of formation at standard conditions (kJ/mol).
• Δ_fH°_solid : Solid 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_subH° : Enthalpy of sublimation at standard conditions (kJ/mol).
• Δ_subH : Enthalpy of sublimation 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).
• 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 : Polar retention indices.
• Δ_fusS : Entropy of fusion at a given temperature (J/mol×K).
• S°_{solid,1 bar} : Solid phase molar entropy at standard conditions (J/mol×K).
• 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).
• T_triple : Triple Point Temperature (K).
• V_c : Critical Volume (m³/kmol).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
ΔcH°liquid	-7360.99 ± 0.50	kJ/mol	NIST
ΔcH°solid	[-7364.60; -7357.10]	kJ/mol
ΔcH°solid	-7357.10 ± 0.80	kJ/mol	NIST
ΔcH°solid	-7360.80 ± 3.90	kJ/mol	NIST
ΔcH°solid	-7364.60 ± 1.00	kJ/mol	NIST
ΔcH°solid	-7361.90 ± 2.80	kJ/mol	NIST
EA	[0.39; 0.39]	eV
EA	0.39 ± 0.02	eV	NIST
EA	0.39 ± 0.06	eV	NIST
ΔfG°	372.04	kJ/mol	Joback Calculated Property
ΔfH°gas	[219.60; 224.40]	kJ/mol
ΔfH°gas	219.60	kJ/mol	NIST
ΔfH°gas	223.30	kJ/mol	NIST
ΔfH°gas	224.40	kJ/mol	NIST
ΔfH°solid	[133.00; 137.80]	kJ/mol
ΔfH°solid	133.00 ± 0.80	kJ/mol	NIST
ΔfH°solid	136.70	kJ/mol	NIST
ΔfH°solid	137.80 ± 2.80	kJ/mol	NIST
ΔfusH°	20.30	kJ/mol	Joback Calculated Property
ΔsubH°	[86.60; 102.00]	kJ/mol
ΔsubH°	102.00 ± 0.40	kJ/mol	NIST
ΔsubH°	102.00	kJ/mol	NIST
ΔsubH°	100.70 ± 0.40	kJ/mol	NIST
ΔsubH°	99.60 ± 1.70	kJ/mol	NIST
ΔsubH°	99.20 ± 0.40	kJ/mol	NIST
ΔsubH°	Outlier 86.60	kJ/mol	NIST
ΔvapH°	[79.60; 79.80]	kJ/mol
ΔvapH°	79.70	kJ/mol	NIST
ΔvapH°	79.80	kJ/mol	NIST
ΔvapH°	79.60	kJ/mol	NIST
IE	[7.66; 7.91]	eV
IE	7.66 ± 0.00	eV	NIST
IE	7.66 ± 0.00	eV	NIST
IE	7.70 ± 0.02	eV	NIST
IE	7.70 ± 0.03	eV	NIST
IE	7.76	eV	NIST
IE	7.87	eV	NIST
IE	7.90 ± 0.05	eV	NIST
IE	7.91 ± 0.05	eV	NIST
log10WS	-4.08		Crippen Calculated Property
logPoct/wat	3.857		Crippen Calculated Property
McVol	156.300	ml/mol	McGowan Calculated Property
Pc	2928.17	kPa	Joback Calculated Property
Inp	[1686.00; 1755.00]
Inp	1755.00		NIST
Inp	1686.00		NIST
Inp	1755.00		NIST
Inp	1755.00		NIST
Inp	1686.00		NIST
I	[2536.00; 2547.00]
I	2547.00		NIST
I	2536.00		NIST
I	2547.00		NIST
I	2536.00		NIST
S°solid,1 bar	247.00	J/mol×K	NIST
Tboil	579.55 ± 0.50	K	NIST
Tc	828.15	K	Joback Calculated Property
Tfus	[394.00; 397.60]	K
Tfus	397.35	K	KDB
Tfus	397.00 ± 2.00	K	NIST
Tfus	397.00 ± 1.50	K	NIST
Tfus	395.15 ± 2.00	K	NIST
Tfus	Outlier 394.00 ± 2.00	K	NIST
Tfus	397.60 ± 0.40	K	NIST
Tfus	397.00 ± 1.00	K	NIST
Tfus	397.00 ± 1.00	K	NIST
Ttriple	[397.40; 398.00]	K
Ttriple	397.40 ± 0.02	K	NIST
Ttriple	398.00 ± 0.50	K	NIST
Vc	0.584	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[352.81; 436.51]	J/mol×K	[577.24; 828.15]
T(K) Ideal gas heat capacity (J/mol×K) 360 380 400 420 440 600 700 800
Cp,gas	352.81	J/mol×K	577.24	Joback Calculated Property
Cp,gas	370.00	J/mol×K	619.06	Joback Calculated Property
Cp,gas	385.74	J/mol×K	660.88	Joback Calculated Property
Cp,gas	400.15	J/mol×K	702.70	Joback Calculated Property
Cp,gas	413.35	J/mol×K	744.52	Joback Calculated Property
Cp,gas	425.43	J/mol×K	786.33	Joback Calculated Property
Cp,gas	436.51	J/mol×K	828.15	Joback Calculated Property
Cp,solid	[235.00; 251.08]	J/mol×K	[298.15; 320.00]
Cp,solid	235.00	J/mol×K	298.15	NIST
Cp,solid	251.08	J/mol×K	320.00	NIST
η	[0.0001520; 0.0024141]	Pa×s	[295.30; 577.24]
T(K) Dynamic viscosity (Pa×s) 0 5.00e-4 1.00e-3 1.50e-3 2.00e-3 2.50e-3 300 400 500
η	0.0024141	Pa×s	295.30	Joback Calculated Property
η	0.0011098	Pa×s	342.29	Joback Calculated Property
η	0.0006154	Pa×s	389.28	Joback Calculated Property
η	0.0003875	Pa×s	436.27	Joback Calculated Property
η	0.0002670	Pa×s	483.26	Joback Calculated Property
η	0.0001965	Pa×s	530.25	Joback Calculated Property
η	0.0001520	Pa×s	577.24	Joback Calculated Property
ΔfusH	[27.37; 27.70]	kJ/mol	[397.40; 398.20]
ΔfusH	27.70	kJ/mol	397.40	NIST
ΔfusH	27.37	kJ/mol	398.00	NIST
ΔfusH	27.40	kJ/mol	398.20	NIST
ΔfusH	27.40	kJ/mol	398.20	NIST
ΔsubH	[86.50; 103.80]	kJ/mol	[309.00; 329.00]
ΔsubH	86.50 ± 0.10	kJ/mol	309.00	NIST
ΔsubH	103.80 ± 2.50	kJ/mol	315.50	NIST
ΔsubH	99.60	kJ/mol	320.50	NIST
ΔsubH	90.80 ± 0.80	kJ/mol	329.00	NIST
ΔvapH	65.50	kJ/mol	499.50	NIST
ΔfusS	68.80	J/mol×K	398.00	NIST

Pressure Dependent Properties

Property	Value	Unit	Pressure (kPa)	Source
Tboilr	[439.70; 579.20]	K	[1.60; 99.20]
Tboilr	439.70	K	1.60	NIST
Tboilr	579.20	K	99.20	NIST

Correlations

Property	Value	Unit	Temperature (K)	Source
Pvap	[1.33; 202.64]	kPa	[434.08; 615.63]	The Yaw...
Equation			ln(Pvp) = A + B/(T + C)
Coefficient A			1.44500e+01
Coefficient B			-4.67696e+03
Coefficient C			-1.03848e+02
Temperature range, min.			434.08
Temperature range, max.			615.63
T(K) Vapor pressure (kPa) 0 50 100 150 200 450 500 550 600
Pvap	1.33	kPa	434.08	Calculated Property
Pvap	3.01	kPa	454.25	Calculated Property
Pvap	6.23	kPa	474.42	Calculated Property
Pvap	11.95	kPa	494.60	Calculated Property
Pvap	21.51	kPa	514.77	Calculated Property
Pvap	36.63	kPa	534.94	Calculated Property
Pvap	59.50	kPa	555.11	Calculated Property
Pvap	92.70	kPa	575.29	Calculated Property
Pvap	139.28	kPa	595.46	Calculated Property
Pvap	202.64	kPa	615.63	Calculated Property
Pvap	[0.23; 2686.24]	kPa	[397.35; 820.00]	KDB Vap...
Equation			ln(Pvp) = A + B/T + C*ln(T) + D*T^2
Coefficient A			9.19966e+01
Coefficient B			-1.21896e+04
Coefficient C			-1.05568e+01
Coefficient D			2.37022e-06
Temperature range, min.			397.35
Temperature range, max.			820.00
T(K) Vapor pressure (kPa) 0 500 1000 1500 2000 2500 400 600 800
Pvap	0.23	kPa	397.35	Calculated Property
Pvap	1.95	kPa	444.31	Calculated Property
Pvap	10.34	kPa	491.27	Calculated Property
Pvap	38.52	kPa	538.23	Calculated Property
Pvap	111.12	kPa	585.19	Calculated Property
Pvap	264.72	kPa	632.16	Calculated Property
Pvap	545.41	kPa	679.12	Calculated Property
Pvap	1005.26	kPa	726.08	Calculated Property
Pvap	1699.54	kPa	773.04	Calculated Property
Pvap	2686.24	kPa	820.00	Calculated Property

Similar Compounds

Find more compounds similar to (E)-Stilbene.

Sources

• KDB Vapor Pressure Data
• Crippen Method
• Crippen Method
• Joback Method
• KDB
• McGowan Method
• NIST Webbook
• The Yaws Handbook of Vapor Pressure

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