Chemical Properties of Methanone, (4-bromophenyl)phenyl- (CAS 90-90-4)

InChI

InChI=1S/C13H9BrO/c14-12-8-6-11(7-9-12)13(15)10-4-2-1-3-5-10/h1-9H

InChI Key

KEOLYBMGRQYQTN-UHFFFAOYSA-N

Formula

C13H9BrO

SMILES

O=C(c1ccccc1)c1ccc(Br)cc1

Molecular Weight¹

261.11

CAS

90-90-4

Other Names

• Benzophenone, 4-bromo-
• p-Bromobenzophenone
• 4-Bromobenzophenone
• USAF do-3

• 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).
• 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
ΔfG°	159.17	kJ/mol	Joback Calculated Property
ΔfH°gas	63.69	kJ/mol	Joback Calculated Property
ΔfusH°	24.00	kJ/mol	Joback Calculated Property
ΔvapH°	62.93	kJ/mol	Joback Calculated Property
log10WS	-4.59		Crippen Calculated Property
logPoct/wat	3.680		Crippen Calculated Property
McVol	165.580	ml/mol	McGowan Calculated Property
Pc	3513.74	kPa	Joback Calculated Property
Inp	[1841.00; 1841.00]
Inp	1841.00		NIST
Inp	1841.00		NIST
Tboil	[623.00; 623.20]	K
Tboil	623.20	K	NIST
Tboil	623.00	K	NIST
Tc	940.54	K	Joback Calculated Property
Tfus	355.60	K	NIST
Vc	0.616	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[376.17; 438.36]	J/mol×K	[675.21; 940.54]
Cp,gas	376.17	J/mol×K	675.21	Joback Calculated Property
Cp,gas	389.24	J/mol×K	719.43	Joback Calculated Property
Cp,gas	401.10	J/mol×K	763.65	Joback Calculated Property
Cp,gas	411.84	J/mol×K	807.88	Joback Calculated Property
Cp,gas	421.56	J/mol×K	852.10	Joback Calculated Property
Cp,gas	430.37	J/mol×K	896.32	Joback Calculated Property
Cp,gas	438.36	J/mol×K	940.54	Joback Calculated Property
η	[0.0001985; 0.0014329]	Pa×s	[411.36; 675.21]
η	0.0014329	Pa×s	411.36	Joback Calculated Property
η	0.0008791	Pa×s	455.34	Joback Calculated Property
η	0.0005878	Pa×s	499.31	Joback Calculated Property
η	0.0004195	Pa×s	543.29	Joback Calculated Property
η	0.0003149	Pa×s	587.26	Joback Calculated Property
η	0.0002460	Pa×s	631.24	Joback Calculated Property
η	0.0001985	Pa×s	675.21	Joback Calculated Property

Similar Compounds

Find more compounds similar to Methanone, (4-bromophenyl)phenyl-.

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.