ZINC octaethylporphyrin
Basic information
- CAS
17632-18-7- Standard SMILES
CCC1=C(CC)c2cc3[n-]c(cc4nc(cc5[n-]c(cc1n2)c(CC)c5CC)C(CC)=C4CC)c(CC)c3CC.[Zn+2]- InChIKey
VVUVWOLOUOYXOI-UHFFFAOYSA-N- Molecular formula
- C36H44N4Zn
- Average molar mass
- 598.1 g/mol
- Monoisotopic mass
- 596.285739
Overview
Zinc octaethylporphyrin is a zinc porphyrin. It has a role as a fluorochrome.
Names & identifiers
- Preferred name
- ZINC octaethylporphyrin
- IUPAC
- zinc 2,3,7,8,12,13,17,18-octaethylporphyrin-22,24-diide
- English name
- Zinc(II) 2,3,7,8,12,13,17,18-(octaethyl)porphyrin
- Molecular formula
- C36H44N4Zn
- Molecular weight
- 598.16
Names & synonyms
zinc octaethylporphyrin17632-18-72,3,7,8,12,13,17,18-Octaethyl-21H,23H-porphine zinc(II)zinc;2,3,7,8,12,13,17,18-octaethylporphyrin-22,24-diideCHEBI:51215VVUVWOLOUOYXOI-XTPDIVBZSA-NDTXSID501313554[2,3,7,8,12,13,17,18-octaethylporphyrinato(2-)-kappa(4)N(21),N(22),N(23),N(24)]zincZn-OEP complexZn(II) OctaethylporphineOctaethylporphyrin-Zn(II)Zinc(II) octaethylporphine
Show more names
octaethyl-21H,23H-porphine zinc(II)2 3 7 8 12 13 17 18-OCTAETHYL-21H 23H-2,3,7,8,12,13,17,18-octaethyl-21h,23h-porphinezizinc(II) 2,3,7,8,12,13,17,18-(octaethyl)porphyrin2,3,7,8,12,13,17,18-Octaethyl-21H,23H-porphine zinc
Database identifiers
- CAS
17632-18-7- PubChem CID
- 519458
- DTXSID
DTXSID501313554- ChEBI
CHEBI:51215
Properties
Computed structural properties
- Topological polar surface area
- 26.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 8
- Heavy atoms
- 41
- Formal charge
- 0
- Complexity
- 1,050
Physicochemical properties
- λmax
- 400 nm · 400 nm
- InChIKey
- VVUVWOLOUOYXOI-XTPDIVBZSA-N
- SMILES
- CCc1c(CC)c2cc3c(CC)c(CC)c4cc5nc(cc6c(CC)c(CC)c(cc1n2)n6[Zn]n34)c(CC)c5CC
- UNSPSC Code
- 12352103 · 12352103
- NACRES
- 23 · NA.23
- WGK Germany
- 3 · 3
- Storage Class
- 11 · 11 - Combustible Solids
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- wgk
- 3
- Storage Class
- 11 - Combustible Solids
Chemistry & industry
Applications
Uses2,3,7,8,12,13,17,18-Octaethyl-21H,23H-porphine zinc(II) ) is formed by metalating 2,3,7,8,12,13,17,18-Octaethyl-21H,23H-porphine with zinc.
General Description2,3,7,8,12,13,17,18-Octaethyl-21H,23H-porphine zinc(II) ) is formed by metalating 2,3,7,8,12,13,17,18-Octaethyl-21H,23H-porphine with zinc.
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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