Physical Properties
Property
Value
Unit
Source
ω
0.4460
KDB
PAff
918.70
kJ/mol
NIST
BasG
887.10
kJ/mol
NIST
Δc H°liquid
-3630.50 ± 0.75
kJ/mol
NIST
Δf H°gas
39.70 ± 0.88
kJ/mol
NIST
Δf H°liquid
-16.80 ± 0.84
kJ/mol
NIST
Δvap H°
[56.50; 56.50]
kJ/mol
Δvap H°
56.50 ± 0.20
kJ/mol
NIST
Δvap H°
56.50
kJ/mol
NIST
IE
7.69
eV
NIST
log 10 WS
-1.64
Crippen Calculated Property
log Poct/wat
1.150
Crippen Calculated Property
McVol
85.920
ml/mol
McGowan Calculated Property
Pc
5100.00
kPa
KDB
Inp
[867.00; 937.00]
Inp
900.00
NIST
Inp
898.00
NIST
Inp
890.00
NIST
Inp
898.00
NIST
Inp
Outlier 937.00
NIST
Inp
867.00
NIST
Inp
900.00
NIST
Inp
902.00
NIST
Inp
900.00
NIST
I
[1579.00; 1635.00]
I
1590.00
NIST
I
1600.00
NIST
I
1610.00
NIST
I
1589.00
NIST
I
1579.00
NIST
I
Outlier 1635.00
NIST
I
1589.00
NIST
I
1601.00
NIST
I
1601.00
NIST
S°liquid
[212.13; 212.24]
J/mol×K
S°liquid
212.24
J/mol×K
NIST
S°liquid
212.13
J/mol×K
NIST
S°liquid
212.13
J/mol×K
NIST
Tboil
405.50
K
KDB
Tc
[661.00; 662.00]
K
Tc
661.00
K
KDB
Tc
662.00
K
Thermod...
Tfus
280.90
K
NIST
Ttriple
[279.91; 280.90]
K
Ttriple
280.83 ± 0.04
K
NIST
Ttriple
280.90 ± 0.02
K
NIST
Ttriple
279.91 ± 0.05
K
NIST
Temperature Dependent Properties
Property
Value
Unit
Temperature (K)
Source
Cp,liquid
[195.30; 195.30]
J/mol×K
[298.15; 298.15]
Cp,liquid
195.30
J/mol×K
298.15
NIST
Cp,liquid
195.30
J/mol×K
298.15
NIST
Cp,liquid
195.30
J/mol×K
298.15
NIST
Δfus H
[9.30; 9.30]
kJ/mol
[280.90; 280.90]
Δfus H
9.30
kJ/mol
280.90
NIST
Δfus H
9.30
kJ/mol
280.90
NIST
Δfus H
9.30
kJ/mol
280.90
NIST
Δfus H
9.30
kJ/mol
280.90
NIST
Δvap H
49.50
kJ/mol
208.00
NIST
Δfus S
[33.09; 33.10]
J/mol×K
[280.90; 280.90]
Δfus S
33.10
J/mol×K
280.90
NIST
Δfus S
33.09
J/mol×K
280.90
NIST
Pressure Dependent Properties
Property
Value
Unit
Pressure (kPa)
Source
Tboilr
[324.70; 438.20]
K
[1.00; 98.70]
Tboilr
324.70
K
1.00
NIST
Tboilr
438.20
K
98.70
NIST
Correlations
Property
Value
Unit
Temperature (K)
Source
Pvap
[1.33; 202.66]
kPa
[332.82; 461.96]
The Yaw...
Equation ln(Pvp) = A + B/(T + C) Coefficient A 1.57451e+01 Coefficient B -4.14564e+03 Coefficient C -6.46240e+01 Temperature range, min. 332.82
Temperature range, max. 461.96
Pvap
1.33
kPa
332.82
Calculated Property
Pvap
2.92
kPa
347.17
Calculated Property
Pvap
5.94
kPa
361.52
Calculated Property
Pvap
11.31
kPa
375.87
Calculated Property
Pvap
20.34
kPa
390.22
Calculated Property
Pvap
34.81
kPa
404.56
Calculated Property
Pvap
57.04
kPa
418.91
Calculated Property
Pvap
89.95
kPa
433.26
Calculated Property
Pvap
137.09
kPa
447.61
Calculated Property
Pvap
202.66
kPa
461.96
Calculated Property
Similar Compounds
Find more compounds similar to 1H-Pyrrole, 2,5-dimethyl- .
Sources
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that the value is more than 2 standard deviations away from the
property mean.