Pt(II) meso-tetra (4-carboxyphenyl) porphine
Catalog Number
ACM94288456-1
CAS
94288-45-6
Synonyms
Platinum(2+);4-[10,15,20-tris(4-carboxyphenyl)porphyrin-22,24-diid-5-yl]benzoic acid
Molecular Weight
983.84
Molecular Formula
C48H28N4O8Pt
Product Information
Canonical SMILES
C1=CC(=CC=C1C2=C3C=CC(=C(C4=NC(=C(C5=CC=C([N-]5)C(=C6C=CC2=N6)C7=CC=C(C=C7)C(=O)O)C8=CC=C(C=C8)C(=O)O)C=C4)C9=CC=C(C=C9)C(=O)O)[N-]3)C(=O)O.[Pt+2]
Inchi
InChI=1S/C48H30N4O8.Pt/c53-45(54)29-9-1-25(2-10-29)41-33-17-19-35(49-33)42(26-3-11-30(12-4-26)46(55)56)37-21-23-39(51-37)44(28-7-15-32(16-8-28)48(59)60)40-24-22-38(52-40)43(36-20-18-34(41)50-36)27-5-13-31(14-6-27)47(57)58;/h1-24H,(H6,49,50,51,52,53,54,55,56,57,58,59,60);/q;+2/p-2
InChIKey
NRXFLRJMHNYICF-UHFFFAOYSA-L
Melting Point
>300 ℃
Purity
95%
Complexity
1820
Hazard Statements
H334
Heavy Atom Count
61
Hydrogen Bond Acceptor Count
12
Hydrogen Bond Donor Count
4
Precautionary Statements
P260 P262
Rotatable Bond Count
8
Signal Word
Danger
Monoisotopic Mass
983.155508
Topological Polar Surface Area
176 Ų
Exact Mass
983.155508
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