Chemical Properties of 1,3-Propanedione, 2-bromo-1,3-diphenyl-

InChI

InChI=1S/C15H11BrO2/c16-13(14(17)11-7-3-1-4-8-11)15(18)12-9-5-2-6-10-12/h1-10,13H

InChI Key

BYAJHZYXPBREEK-UHFFFAOYSA-N

Formula

C15H11BrO2

SMILES

O=C(c1ccccc1)C(Br)C(=O)c1ccccc1

Molecular Weight¹

303.15

Other Names

• Bromodibenzoylmethane
• Dibenzoylbromomethane
• Methane, dibenzoylbromo-
• 2-Bromo-1,3-diphenyl-1,3-propanedione

• ω : Acentric Factor.
• 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).
• 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).
• 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

Correlations

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[224.70; 543.79]	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			-5.73300e+01
Coefficient B			1.25910e+00
Coefficient C			-8.91800e-04
Coefficient D			2.33820e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	224.70	J/mol×K	273.00	Calculated Property
Cp,gas	286.85	J/mol×K	353.78	Calculated Property
Cp,gas	340.60	J/mol×K	434.56	Calculated Property
Cp,gas	386.69	J/mol×K	515.33	Calculated Property
Cp,gas	425.86	J/mol×K	596.11	Calculated Property
Cp,gas	458.85	J/mol×K	676.89	Calculated Property
Cp,gas	486.40	J/mol×K	757.67	Calculated Property
Cp,gas	509.25	J/mol×K	838.44	Calculated Property
Cp,gas	528.13	J/mol×K	919.22	Calculated Property
Cp,gas	543.79	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0014639; 0.0001790]	Pa×s	[456.31; 722.22]	Joback Predicted correlation
Equation			Y = exp(A + B/T + C·ln(T) + D·T^E) Y is η in Pa×s, T in K
Coefficient A			-1.22348e+01
Coefficient B			2.60466e+03
Coefficient C			0.00000e+00
Coefficient D			0.00000e+00
Coefficient E			0.00000e+00
Comment			Liquid phase. Joback/Reid (1987), valid from Tf to 0.7·Tc.
Temperature range, min.			456.31
Temperature range, max.			722.22
η	0.0014639	Pa×s	456.31	Calculated Property
η	0.0010346	Pa×s	485.86	Calculated Property
η	0.0007608	Pa×s	515.40	Calculated Property
η	0.0005785	Pa×s	544.95	Calculated Property
η	0.0004524	Pa×s	574.49	Calculated Property
η	0.0003624	Pa×s	604.04	Calculated Property
η	0.0002964	Pa×s	633.58	Calculated Property
η	0.0002468	Pa×s	663.13	Calculated Property
η	0.0002087	Pa×s	692.67	Calculated Property
η	0.0001790	Pa×s	722.22	Calculated Property

Similar Compounds

Find more compounds similar to 1,3-Propanedione, 2-bromo-1,3-diphenyl-.

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.
Calculated This icon marks a calculated value or equation: a prediction, not a measurement.
These property values are available through the Cheméo API. A free account gives you an access key.