Chemical Properties of Tetra(p-bromophenyl)porphyrin (CAS 29162-73-0)

Tetra(p-bromophenyl)porphyrin

InChI
InChI=1S/C44H26Br4N4/c45-29-9-1-25(2-10-29)41-33-17-19-35(49-33)42(26-3-11-30(46)12-4-26)37-21-23-39(51-37)44(28-7-15-32(48)16-8-28)40-24-22-38(52-40)43(36-20-18-34(41)50-36)27-5-13-31(47)14-6-27/h1-24,49,52H/b41-33-,41-34-,42-35-,42-37-,43-36-,43-38-,44-39-,44-40-
InChI Key
ANWXWWSYNQLVED-LWQDQPMZSA-N
Formula
C44H26Br4N4
SMILES
Brc1ccc(-c2c3nc(c(-c4ccc(Br)cc4)c4ccc([nH]4)c(-c4ccc(Br)cc4)c4nc(c(-c5ccc(Br)cc5)c5ccc2[nH]5)C=C4)C=C3)cc1
Molecular Weight1
930.32
CAS
29162-73-0
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Physical Properties

Property Value Unit Source
ω 1.1779 Relay (1.0) Calculated Property
ΔcH°solid -21784.00 ± 11.00 kJ/mol NIST
ΔfG° 867.62 kJ/mol Relay (1.0-beta) Calculated Property
ΔfH°gas 934.03 kJ/mol Relay (1.0) Calculated Property
ΔfH°solid 754.00 ± 13.00 kJ/mol NIST
ΔsubH° 284.00 kJ/mol NIST
ΔvapH° 283.77 kJ/mol Relay (1.0) Calculated Property
IE 6.61 eV Relay (1.0) Calculated Property
log10WS -16.51 Relay (1.0) Calculated Property
logPoct/wat 13.410 Crippen Calculated Property
McVol 544.100 ml/mol McGowan Calculated Property
Pc 284.55 kPa Relay (1.0-beta) Calculated Property
Tboil 1114.29 K Relay (1.0) Calculated Property
Tc 1728.83 K Relay (1.0) Calculated Property
Tfus 780.39 K Relay (1.0) Calculated Property
Vc 1.843 m3/kmol Relay (1.0) Calculated Property

Similar Compounds

Tetraphenylporphyrin. 21H,23H-Porphin,5,10,15,20-tetrakis(4-methylphenyl)-. Tetra(p-nitrophenyl)porphyrin. Tetra(3-pyridyl)porphyrin. 5,10,15,20-Tetra(2-aminophenyl)-21H,23H-porphine. (2-Hydroxy-3-phenyl-1,2-dihydroquinoxalin-1-yl)phenyl(3-phenyl-1-benzyl-1,2-dihydroquinoxalin-2-yl)methane. Zinc octaethylporphyrin chloride. 1H-Indole-3-ethanol, 2-(5-ethenyl-1-azabicyclo[2.2.2]oct-2-yl)-, [1S-(1«alpha»,2«alpha»,4«alpha»,5«beta»)]-. Epibaptifoline. Baptifoline. Glyceollin III, TMS. 1H-pyrazolo[3,4-d]pyrimidine, 4-(methylthio)-1-beta-d-ribofuranosyl-, 2',3',5'-tribenzoate. Glyceollin V, TMS. Argentamin. risperidone.

Find more compounds similar to Tetra(p-bromophenyl)porphyrin.

Sources

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