Basic information
- Standard SMILES
O=S(=O)(O)c1cc(O)c2ccc3c(S(=O)(=O)O)cc(S(=O)(=O)O)c4ccc1c2c34- InChIKey
OBJOZRVSMLPASY-UHFFFAOYSA-N- Molecular formula
- C16H10O10S3
- Average molar mass
- 458.4 g/mol
- Monoisotopic mass
- 457.94360952
Names & identifiers
- Preferred name
- D&C Green No. 8 free acid
- IUPAC
- 8-hydroxypyrene-1,3,6-trisulfonic acid
- English name
- 8-Hydroxypyrene-1,3,6-trisulfonicacidtrisodiumsalt
- Molecular formula
- C16H10O10S3
- Molecular weight
- 458.44
Names & synonyms
Show more names
Database identifiers
- CAS
27928-00-3- PubChem CID
- 61389
- DTXSID
DTXSID00275670- UNII
- 63Z73E2H7M
- Nikkaji
- J645.132B
Properties
Computed structural properties
- XLogP
- 0.9
- Topological polar surface area
- 208 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 10
- Rotatable bonds
- 3
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 971
Physicochemical properties
- Density
- 2.004 · 2.004±0.06 g/cm3(Predicted)
- pka
- 0 · -0+-.0.30(Predicted)
- FDA UNII
- 63 Z73E2H7M · 63Z73E2H7M
Chemistry & industry
Pharmacology
MeSH Pharmacological Classification
Chemicals that emit light after excitation by light. The wave length of the emitted light is usually longer than that of the incident light. Fluorochromes are substances that cause fluorescence in other substances, i.e., dyes used to mark or label other compounds with fluorescent tags.
Substances used in the processing or storage of foods or animal feed including ANTIOXIDANTS; FOOD PRESERVATIVES; FOOD COLORING AGENTS; FLAVORING AGENTS; ANTI-INFECTIVE AGENTS; EXCIPIENTS and other similarly used substances. Many of the same substances are used as PHARMACEUTIC AIDS.
Chemicals and substances that impart color including soluble dyes and insoluble pigments. They are used in INKS; PAINTS; and as INDICATORS AND REAGENTS.
Applications
Uses8-Hydroxypyrene-1,3,6-trisulfonicacidtrisodiumsalt useful for optical sensor applications. Fluorescent pH indicator for physiological range.
Upstream & downstream products
Upstream raw materials
Suppliers3 total
Related reactions
No reaction records under the current filter.
Linked notes
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