Chemical Properties of Butane, 1,2:3,4-diepoxy-, (.+/-.)- (CAS 298-18-0)

InChI

InChI=1S/C4H6O2/c1-3(5-1)4-2-6-4/h3-4H,1-2H2/t3-,4-/m0/s1

InChI Key

ZFIVKAOQEXOYFY-IMJSIDKUSA-N

Formula

C4H6O2

SMILES

C1OC1C1CO1

Molecular Weight¹

86.09

CAS

298-18-0

Other Names

• 2,2'-Bioxirane, (R*,R*)-(.+/-.)-
• (.+/-.)-1,2:3,4-Diepoxybutane
• Butane, 1,2:3,4-diepoxy-, DL-
• DL-Diepoxybutane
• Butadiene diepoxide, dl-
• Butane, (.+/-.)-1,2:3,4-diepoxy-
• (R*,R*)-(.+/-.)-2,2'-Bioxirane
• dl-Butadiene dioxide
• 1,2:3,4-Dianhydro-dl-threitol
• dl-1,2:3,4-Diepoxybutane
• 1,2:3,4-Diepoxybutane, dl-
• 2,2'-Bioxirane, (2R,2'R)-rel-
• 1,2,3,4-diepoxybutane

• 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_boilr : Boiling point at reduced pressure (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°	-67.94	kJ/mol	Joback Calculated Property
ΔfH°gas	-244.29	kJ/mol	Joback Calculated Property
ΔfusH°	18.34	kJ/mol	Joback Calculated Property
ΔvapH°	33.34	kJ/mol	Joback Calculated Property
log10WS	0.32		Crippen Calculated Property
logPoct/wat	-0.216		Crippen Calculated Property
McVol	57.240	ml/mol	McGowan Calculated Property
Pc	5406.57	kPa	Joback Calculated Property
Tboil	[417.20; 417.60]	K
Tboil	417.20	K	NIST
Tboil	417.60	K	NIST
Tc	558.39	K	Joback Calculated Property
Tfus	[260.40; 277.00]	K
Tfus	277.00	K	NIST
Tfus	260.40 ± 0.60	K	NIST
Vc	0.215	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[109.07; 161.70]	J/mol×K	[358.30; 558.39]
Cp,gas	109.07	J/mol×K	358.30	Joback Calculated Property
Cp,gas	119.63	J/mol×K	391.65	Joback Calculated Property
Cp,gas	129.41	J/mol×K	425.00	Joback Calculated Property
Cp,gas	138.46	J/mol×K	458.35	Joback Calculated Property
Cp,gas	146.83	J/mol×K	491.69	Joback Calculated Property
Cp,gas	154.56	J/mol×K	525.04	Joback Calculated Property
Cp,gas	161.70	J/mol×K	558.39	Joback Calculated Property
η	[0.0005861; 0.0007038]	Pa×s	[223.86; 358.30]
η	0.0007038	Pa×s	223.86	Joback Calculated Property
η	0.0006732	Pa×s	246.27	Joback Calculated Property
η	0.0006488	Pa×s	268.67	Joback Calculated Property
η	0.0006288	Pa×s	291.08	Joback Calculated Property
η	0.0006122	Pa×s	313.49	Joback Calculated Property
η	0.0005981	Pa×s	335.89	Joback Calculated Property
η	0.0005861	Pa×s	358.30	Joback Calculated Property

Pressure Dependent Properties

Property	Value	Unit	Pressure (kPa)	Source
Tboilr	[317.60; 330.20]	K	[1.80; 3.30]
Tboilr	317.60	K	1.80	NIST
Tboilr	330.20	K	3.30	NIST

Similar Compounds

Find more compounds similar to Butane, 1,2:3,4-diepoxy-, (.+/-.)-.

Sources

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

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