Chemical Properties of Bicyclo[4.2.0]octa-1,3,5-triene, 7-bromo- (CAS 21120-91-2)

InChI

InChI=1S/C8H7Br/c9-8-5-6-3-1-2-4-7(6)8/h1-4,8H,5H2

InChI Key

AYNXHFRDABNHRX-UHFFFAOYSA-N

Formula

C8H7Br

SMILES

BrC1Cc2ccccc21

Molecular Weight¹

183.04

CAS

21120-91-2

Other Names

• 1-bromobenzocyclobutene

• 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).
• 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

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[198.50; 255.51]	J/mol×K	[482.73; 722.52]
Cp,gas	198.50	J/mol×K	482.73	Joback Calculated Property
Cp,gas	210.28	J/mol×K	522.70	Joback Calculated Property
Cp,gas	221.02	J/mol×K	562.66	Joback Calculated Property
Cp,gas	230.82	J/mol×K	602.63	Joback Calculated Property
Cp,gas	239.77	J/mol×K	642.59	Joback Calculated Property
Cp,gas	247.97	J/mol×K	682.56	Joback Calculated Property
Cp,gas	255.51	J/mol×K	722.52	Joback Calculated Property
η	[0.0006653; 0.0014198]	Pa×s	[300.12; 482.73]
η	0.0014198	Pa×s	300.12	Joback Calculated Property
η	0.0011806	Pa×s	330.56	Joback Calculated Property
η	0.0010127	Pa×s	360.99	Joback Calculated Property
η	0.0008896	Pa×s	391.42	Joback Calculated Property
η	0.0007963	Pa×s	421.86	Joback Calculated Property
η	0.0007235	Pa×s	452.29	Joback Calculated Property
η	0.0006653	Pa×s	482.73	Joback Calculated Property

Similar Compounds

Find more compounds similar to Bicyclo[4.2.0]octa-1,3,5-triene, 7-bromo-.

Sources

• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

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