Chemical Properties of Difluorohydroxyborane (CAS 13867-66-8)

InChI

InChI=1S/BF2HO/c2-1(3)4/h4H

InChI Key

OKVJWADVFPXWQD-UHFFFAOYSA-N

Formula

BF2HO

SMILES

OB(F)F

Molecular Weight¹

65.81

CAS

13867-66-8

• ω : Acentric Factor.
• C_p,gas : Ideal gas heat capacity (J/mol×K).
• Δ_fG° : Standard Gibbs free energy of formation (kJ/mol).
• Δ_fH°_gas : Enthalpy of formation at standard conditions (kJ/mol).
• IE : Ionization energy (eV).
• logP_oct/wat : Octanol/Water partition coefficient.
• 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

Cheméo can also estimate Enthalpy of vaporization at standard conditions, Log10 of Water solubility in mol/l 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	[51.95; 92.01]	J/mol×K	[298.00; 1100.00]	NIST
Equation			Y = A + B·t + C·t² + D·t³ + E/t², t = T/1000 Y is Cp,gas in J/mol×K, T in K
Coefficient A			6.12571e+00
Coefficient B			1.90052e+02
Coefficient C			-1.52415e+02
Coefficient D			4.59370e+01
Coefficient E			1.34063e-01
Reference			Chase, 1998
Temperature range, min.			298.00
Temperature range, max.			1100.00
Cp,gas	51.95	J/mol×K	298.00	Calculated Property
Cp,gas	60.42	J/mol×K	387.11	Calculated Property
Cp,gas	67.62	J/mol×K	476.22	Calculated Property
Cp,gas	73.58	J/mol×K	565.33	Calculated Property
Cp,gas	78.41	J/mol×K	654.44	Calculated Property
Cp,gas	82.30	J/mol×K	743.56	Calculated Property
Cp,gas	85.41	J/mol×K	832.67	Calculated Property
Cp,gas	87.94	J/mol×K	921.78	Calculated Property
Cp,gas	90.08	J/mol×K	1010.89	Calculated Property
Cp,gas	92.01	J/mol×K	1100.00	Calculated Property
Cp,gas	[91.85; 107.28]	J/mol×K	[1100.00; 6000.00]	NIST
Equation			Y = A + B·t + C·t² + D·t³ + E/t², t = T/1000 Y is Cp,gas in J/mol×K, T in K
Coefficient A			9.57136e+01
Coefficient B			6.44512e+00
Coefficient C			-1.24288e+00
Coefficient D			8.31730e-02
Coefficient E			-1.15685e+01
Reference			Chase, 1998
Temperature range, min.			1100.00
Temperature range, max.			6000.00
Cp,gas	91.85	J/mol×K	1100.00	Calculated Property
Cp,gas	99.04	J/mol×K	1644.44	Calculated Property
Cp,gas	102.32	J/mol×K	2188.89	Calculated Property
Cp,gas	104.19	J/mol×K	2733.33	Calculated Property
Cp,gas	105.34	J/mol×K	3277.78	Calculated Property
Cp,gas	106.04	J/mol×K	3822.22	Calculated Property
Cp,gas	106.48	J/mol×K	4366.67	Calculated Property
Cp,gas	106.76	J/mol×K	4911.11	Calculated Property
Cp,gas	107.00	J/mol×K	5455.56	Calculated Property
Cp,gas	107.28	J/mol×K	6000.00	Calculated Property

Similar Compounds

Find more compounds similar to Difluorohydroxyborane.

Sources

• Cheméo Relay (1.0)
• Cheméo Relay (1.0, beta) Beta: served but experimental, data-limited and below our cross-validation release bar; the Joback value is recommended where available.
• Crippen Method
• Crippen Method
• NIST Webbook

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