(1Z,4Z,9Z,15Z)-5,10,15,20-Tetrakis-pentafluorophenyl-porphyrin
Basic information
- CAS
25440-14-6- Standard SMILES
Fc1c(F)c(F)c(-c2c3nc(c(-c4c(F)c(F)c(F)c(F)c4F)c4ccc([nH]4)c(-c4c(F)c(F)c(F)c(F)c4F)c4ccc([nH]4)c(-c4c(F)c(F)c(F)c(F)c4F)c4nc2C=C4)C=C3)c(F)c1F- InChIKey
GBAPBSUXEFFUAD-UHFFFAOYSA-N- Molecular formula
- C44H10F20N4
- Average molar mass
- 974.5 g/mol
- Monoisotopic mass
- 974.0586096
Names & identifiers
- Preferred name
- (1Z,4Z,9Z,15Z)-5,10,15,20-Tetrakis-pentafluorophenyl-porphyrin
- IUPAC
- 5,10,15,20-tetrakis(2,3,4,5,6-pentafluorophenyl)-21,22-dihydroporphyrin
- English name
- 5,10,15,20-Tetrakis(pentafluorophenyl)-21H,23H-porphine
- Molecular formula
- C44H10F20N4
- Molecular weight
- 974.55
Names & synonyms
CHEMBL285389SCHEMBL30184124BDBM50070472F790972(1Z,4Z,9Z,15Z)-5,10,15,20-Tetrakis-pentafluorophenyl-porphyrinMESO-TETRA(PENTAFLUOROPHENYL)PORPHINEDK7616RARECHEM AS SA 0031Iron(III) ionophore IVmeso-tetra(pentafluorophenyl)porphyrintetrakis(pentafluorophenyl)-21H,23H-porphine5,10,15,20-Tetrakis(perfluorophenyl)porphyrin
Show more names
5,10,15,20-TETRAKIS(PENTAFLUOROPHENYL)PORPHYRIN5,10,15,20-Tetrakis(pentafluorophenyl)-21H,23H-MESO-TETRA(PENTAFLUOROPHENYL)PORPHINE CHLORIN FREE
Database identifiers
- CAS
25440-14-6- PubChem CID
- 3671775
- DTXSID
Properties
Computed structural properties
- XLogP
- 12.4
- Topological polar surface area
- 57.4 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 22
- Rotatable bonds
- 4
- Heavy atoms
- 68
- Formal charge
- 0
- Complexity
- 1,590
Physicochemical properties
- Density
- 1.5032 · 1.5032 (estimate)
- storage temp.
- Keep in dark place,Sealed in dry,Room Temperature
- form
- Crystalline Powder
- color
- Violet or purple
- λmax
- 416 nm507 · 416 nm507 nm (2nd)
- BRN
- 604408 · 604408
- InChIKey
- VJEVAXUMNMFKDT-OTHQCIQNSA-N
- SMILES
- Fc1c(F)c(F)c(c(F)c1F)-c2c3ccc(n3)c(-c4c(F)c(F)c(F)c(F)c4F)c5ccc([nH]5)c(-c6c(F)c(F)c(F)c(F)c6F)c7ccc(n7)c(-c8c(F)c(F)c(F)c(F)c8F)c9ccc2[nH]9
- CAS DataBase Reference
- 25440 · 25440-14-6
- UNSPSC Code
- 12352103 · 12352103
- NACRES
- 23 · NA.23
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 315 · H315-H319-H335
- Precautionary statements
- 261 · P261-P264-P271-P280-P302+P352-P305+P351+P338
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
- PPE
- dust mask type N95 (US), Eyeshields, Gloves
- wgk
- 3
- hs_code
- 29339900
- risk_code
- 36/37/38
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xi
- safety_code
- 26-36
- Storage Class
- 11 - Combustible Solids
- target organs
- Respiratory system
- Hazard statements
- H315-H319-H335
- Hazard Classifications
- Eye Irrit. 2Skin Irrit. 2STOT SE 3
- Precautionary statements
- P261-P264-P271-P280-P302+P352-P305+P351+P338
Chemistry & industry
Applications
Uses5,10,15,20-Tetrakis(pentafluorophenyl)porphyrin has been used as a biomarker in a study. 1
General DescriptionVisit our Sensor Applications portal to learn more.
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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