Chemical Properties of 7H-Benzo[c]fluoren-7-one (CAS 6051-98-5)

InChI

InChI=1S/C17H10O/c18-17-14-8-4-3-7-13(14)16-12-6-2-1-5-11(12)9-10-15(16)17/h1-10H

InChI Key

USYWCEDYVLPNHH-UHFFFAOYSA-N

Formula

C17H10O

SMILES

O=C1c2ccccc2-c2c1ccc1ccccc21

Molecular Weight¹

230.26

CAS

6051-98-5

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• 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).
• 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).
• 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
ΔfH°gas	127.61	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	24.49	kJ/mol	Joback Calculated Property
ΔvapH°	106.77	kJ/mol	Relay (1.0) Calculated Property
IE	7.93	eV	Relay (1.0) Calculated Property
log10WS	-5.99		Relay (1.0) Calculated Property
logPoct/wat	4.051		Crippen Calculated Property
McVol	174.120	ml/mol	McGowan Calculated Property
Pc	2953.69	kPa	Joback Calculated Property
Inp	[388.55; 390.28]
Inp	390.28		NIST
Inp	388.55		NIST
Inp	388.55		NIST
Inp	390.28		NIST
Tboil	697.11	K	Relay (1.0) Calculated Property
Tc	1014.57	K	Relay (1.0) Calculated Property
Tfus	435.37	K	Relay (1.0) Calculated Property
Vc	0.664	m3/kmol	Relay (1.0) Calculated Property

Cheméo can also estimate Standard Gibbs free energy of formation, Acentric Factor for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.

Correlations

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[208.70; 528.07]	J/mol×K	[273.00; 1000.00]	Joback Predicted correlation
Equation			Y = A + B·T + C·T² + D·T³ + E·T⁴ Y is Cp,gas in J/mol×K, T in K
Coefficient A			-7.84300e+01
Coefficient B			1.30710e+00
Coefficient C			-1.02340e-03
Coefficient D			3.22800e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	208.70	J/mol×K	273.00	Calculated Property
Cp,gas	270.20	J/mol×K	353.78	Calculated Property
Cp,gas	322.81	J/mol×K	434.56	Calculated Property
Cp,gas	367.56	J/mol×K	515.33	Calculated Property
Cp,gas	405.46	J/mol×K	596.11	Calculated Property
Cp,gas	437.54	J/mol×K	676.89	Calculated Property
Cp,gas	464.82	J/mol×K	757.67	Calculated Property
Cp,gas	488.33	J/mol×K	838.44	Calculated Property
Cp,gas	509.07	J/mol×K	919.22	Calculated Property
Cp,gas	528.07	J/mol×K	1000.00	Calculated Property

Similar Compounds

Find more compounds similar to 7H-Benzo[c]fluoren-7-one.

Sources

• Cheméo Relay (1.0)
• 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.
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