基本情報
- 標準SMILES
O=S(=O)([O-])c1cc(O)c2ccc3c(S(=O)(=O)[O-])cc(S(=O)(=O)[O-])c4ccc1c2c34.[Na+].[Na+].[Na+]- InChIKey
KXXXUIKPSVVSAW-UHFFFAOYSA-K- 分子式
- C16H7Na3O10S3
- 平均分子量
- 524.4 g/mol
- 単同位体質量
- 523.88944226
概要
Pyranine is an organic sodium salt. It has a role as a fluorochrome. It contains a pyranine(3-). It derives from a hydride of a pyrene.
名称と識別子
- 優先名称
- Pyranine
- IUPAC
- trisodium;8-hydroxypyrene-1,3,6-trisulfonate
名称と別名
PyranineSolvent green 7Pyrene 1Green 8Japan Green 204Japan Green No. 20411389 GreenD&C Green 8Pyranine 120Green 204Green No. 204Trisodium 1-hydroxy-3,6,8-pyrenetrisulfonate
名称をさらに表示
8-Hydroxypyrene-1,3,6-trisulfonic acid sodium saltDTXSID00275670RefChem:870405D.C. Green No. 8DTXCID001969376358-69-6Sodium 8-hydroxypyrene-1,3,6-trisulfonateHPTS
データベース識別子
- CAS
6358-69-6- PubChem CID
- 61388
- DTXSID
DTXSID4041739- ChEBI
CHEBI:52083- UNII
- I2W85YOX9L
- EC Number
- 228-783-6
物性
構造計算による物性
- 極性表面積
- 217 Ų
- 水素結合供与体数
- 1
- 水素結合受容体数
- 10
- 回転可能結合数
- 0
- 重原子数
- 32
- 形式電荷
- 0
- 複雑度
- 931
実験および物理化学的性質
Chemical ClassesDyes -> Indicator Dyes
CosmeticsCosmetic colorant; Hair dyeing
Food AdditivesDrugs, Cosmetics -> FDA Regulatory Status of Color Additives
Physical Description
Liquid; Wet Solid
Solid; Highly soluble in water; [Merck Index] Yellowish or green powder; Soluble in water; [MSDSonline]
安全と法規制
GHS分類
GHS Classification
This chemical does not meet GHS hazard criteria for 95.2% (2184 of 2294) of all reports.
Not Classified
Aggregated GHS information provided per 2294 reports by companies from 6 notifications to the ECHA C&L Inventory.
危険有害性情報
Regulatory Information
Chemical: 1,3,6-Pyrenetrisulfonic acid, 8-hydroxy-, trisodium salt
1,3,6-Pyrenetrisulfonic acid, 8-hydroxy-, sodium salt (1:3) is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of 1,3,6-Pyrenetrisulfonic acid, 8-hydroxy-, sodium salt (1:3) are required to report information about their production and use of this chemical to the EPA under the Toxic Substances Control Act (TSCA). (40 eCFR Part 711)
REACH registered substance: Trisodium 8-hydroxypyrene-1,3,6-trisulphonate (EC: 228-783-6)
1,3,6-Pyrenetrisulfonic acid, 8-hydroxy-, trisodium salt: Does not have an individual approval but may be used as a component in a product covered by a group standard. It is not approved for use as a chemical in its own right.
Hazards SummaryAn irritant; [MSDSonline] See POLYCYCLIC AROMATIC HYDROCARBONS.
EPA Safer ChemicalChemical: C.I. Solvent Green 7
Hazard Classes and CategoriesNot Classified
化学と産業
薬理情報
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.
用途と製造
UsesUsed as a pH indicator for biological systems, a biological stain, and a dye (solvents, cosmetics, and pharmaceuticals); [Merck Index]
U.S. Production2023: 178,000 lb
Consumer UsesNot Known or Reasonably Ascertainable
Household ProductsInformation on 20 consumer products that contain D&C Green #8 (C.I. 59040) in the following categories is provided:
Use Classification
EPA Safer Chemical Functional Use Classes -> Colorants
Safer Chemical Classes -> Yellow triangle - The chemical has met Safer Choice Criteria for its functional ingredient-class, but has some hazard profile issues
Cosmetics -> Cosmetic colorant; Hair dyeing
General Manufacturing Information1,3,6-Pyrenetrisulfonic acid, 8-hydroxy-, sodium salt (1:3): ACTIVE
関連反応
6 件
関連ノート
読み込み中…