5,10,15,20-Tetrakis(2,6-dichlorophenyl)porphine

Catalog Number	ACM37083377-3
CAS	37083-37-7
Structure
Synonyms	5,10,15,20-Tetrakis(2,6-dichlorophenyl)-21H,23H-Porphine
IUPAC Name	5,10,15,20-tetrakis(2,6-dichlorophenyl)-21,23-dihydroporphyrin
Molecular Weight	890.30
Molecular Formula	C44H22Cl8N4
Canonical SMILES	C1=CC(=C(C(=C1)Cl)C2=C3C=CC(=C(C4=NC(=C(C5=CC=C(N5)C(=C6C=CC2=N6)C7=C(C=CC=C7Cl)Cl)C8=C(C=CC=C8Cl)Cl)C=C4)C9=C(C=CC=C9Cl)Cl)N3)Cl
InChI	UQASJTNIEXIESH-UHFFFAOYSA-N
InChI Key	InChI=1S/C44H22Cl8N4/c45-21-5-1-6-22(46)37(21)41-29-13-15-31(53-29)42(38-23(47)7-2-8-24(38)48)33-17-19-35(55-33)44(40-27(51)11-4-12-28(40)52)36-20-18-34(56-36)43(32-16-14-30(41)54-32)39-25(49)9-3-10-26(39)50/h1-20,53,56H
Purity	98%
Appearance	Soild
Exact Mass	889.929368
Heavy Atom Count	56
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	2
Monoisotopic Mass	885.935268
Rotatable Bond Count	4
Topological Polar Surface Area	57.4 Ų