Basic information
- CAS
71720-86-0- Standard SMILES
O=S(=O)([O-])c1cc(S(=O)(=O)[O-])c2cc(N=Nc3ccc(N=Nc4ccc(Nc5nc(F)nc(F)c5Cl)cc4)cc3)cc(S(=O)(=O)[O-])c2c1.[K+].[K+].[K+]- InChIKey
CMWDUSGRNJDXKX-UHFFFAOYSA-K- Molecular formula
- C26H13ClF2K3N7O9S3
- Average molar mass
- 854.4 g/mol
- Monoisotopic mass
- 852.850467
Names & identifiers
- Preferred name
- 1,3,5-Naphthalenetrisulfonic acid, 7-[2-[4-[2-[4-[(5-chloro-2,6-difluoro-4-pyrimidinyl)amino]phenyl]diazenyl]phenyl]diazenyl]-, potassium salt (1:3)
- IUPAC
- tripotassium;7-[[4-[[4-[(5-chloro-2,6-difluoropyrimidin-4-yl)amino]phenyl]diazenyl]phenyl]diazenyl]naphthalene-1,3,5-trisulfonate
- English name
- tripotassium 7-[[4-[[4-[(5-chloro-2,6-difluoro-4-pyrimidinyl)amino]phenyl]azo]phenyl]azo]naphthalene-1,3,5-trisulphonate
- Molecular formula
- C26H13ClF2K3N7O9S3
- Molecular weight
- 854.3626264
Names & synonyms
71720-86-0EINECS 275-914-8DTXSID708901521,3,5-Naphthalenetrisulfonic acid, 7-((4-((4-((5-chloro-2,6-difluoro-4-pyrimidinyl)amino)phenyl)azo)phenyl)azo)-, tripotassium salt1,3,5-Naphthalenetrisulfonic acid, 7-(2-(4-(2-(4-((5-chloro-2,6-difluoro-4-pyrimidinyl)amino)phenyl)diazenyl)phenyl)diazenyl)-, potassium salt (1:3)1,3,5-Naphthalenetrisulfonic acid, 7-[[4-[[4-[(5-chloro-2,6-difluoro-4-pyrimidinyl)amino]phenyl]azo]phenyl]azo]-, tripotassium salt1,3,5-Naphthalenetrisulfonic acid, 7-[2-[4-[2-[4-[(5-chloro-2,6-difluoro-4-pyrimidinyl)amino]phenyl]diazenyl]phenyl]diazenyl]-, potassium salt (1:3)RefChem:72285DTXCID1010294047-4-4-(5-chloro-2,6-difluoro-4-pyrimidinyl)aminophenylazophenylazonaphthalene-1,3,5-trisulphonate (potassium salt)CMWDUSGRNJDXKX-UHFFFAOYSA-KNS00063690
Show more names
WZNOBCJJBKUYMS-BCYCOXNYSA-Ktripotassium 7-[[4-[[4-[(5-chloro-2,6-difluoro-4-pyrimidinyl)amino]phenyl]azo]phenyl]azo]naphthalene-1,3,5-trisulphonate
Properties
Computed structural properties
- Topological polar surface area
- 284 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 18
- Rotatable bonds
- 6
- Heavy atoms
- 51
- Formal charge
- 0
- Complexity
- 1,460
Physicochemical properties
- EPA Substance Registry System
- 1 · 1,3,5-Naphthalenetrisulfonic acid, 7-[[4-[[4-[(5-chloro-2,6-difluoro-4-pyrimidinyl)amino]phenyl]azo]phenyl]azo]-, tripotassium salt (71720-86-0)
- TSCA
- TSCA listed
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
This chemical does not meet GHS hazard criteria for 100% (6 of 6) of all reports.
Not Classified
Aggregated GHS information provided per 6 reports by companies from 1 notifications to the ECHA C&L Inventory.
Hazard information
Regulatory InformationChemical: 1,3,5-Naphthalenetrisulfonic acid, 7-[[4-[[4-[(5-chloro-2,6-difluoro-4-pyrimidinyl)amino]phenyl]azo]phenyl]azo]-, tripotassium salt
Hazard Classes and CategoriesNot Classified
Safety data
- tsca
- TSCA listed
Chemistry & industry
Uses & manufacturing
General Manufacturing Information1,3,5-Naphthalenetrisulfonic acid, 7-[2-[4-[2-[4-[(5-chloro-2,6-difluoro-4-pyrimidinyl)amino]phenyl]diazenyl]phenyl]diazenyl]-, potassium salt (1:3): ACTIVE
Suppliers1 total
XIAMEN AMITY INDUSTRY AND TRADE CO., LTD.+8618950047208 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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