| CAS Number | 80471-69-8 |
| Catalog Number | AG003G6S(AGN-PC-0UH5UI) |
| Chemical Name | 2,7-Dichlorofluorescein Sodium Salt , |
| IUPAC Name | disodium;2-(2,7-dichloro-3-oxido-6-oxoxanthen-9-yl)benzoate |
| InChI | InChI=1S/C20H10Cl2O5.2Na/c21-13-5-11-17(7-15(13)23)27-18-8-16(24)14(22)6-12(18)19(11)9-3-1-2-4-10(9)20(25)26;;/h1-8,23H,(H,25,26);;/q;2*+1/p-2 |
| InChI Key | SZSVOWHDMGIUKH-UHFFFAOYSA-L |
| MDL Number | MFCD00008603 |
| Molecular Formula | C20H8Cl2Na2O5 |
| Molecular Weight | 445.1601 |
| SMILES | O=C1OC2(C3=C(OC4=C2C=C(Cl)C([O-])=C4)C=C([O-])C(Cl)=C3)C5=C1C=CC=C5.[Na+].[Na+] |
| Synonyms | 2',7'-Dichlorofluorescein Sodium Salt,
80471-69-8,
DTXSID00435171,
MFCD00070511,
2',7'-dichlorofluorescein disodium salt,
D0424,
FT-0745838,
C-53304,
disodium 2-(2,7-dichloro-6-oxido-3-oxo-3H-xanthen-9-yl)benzoate,
sodium 2-(2,7-dichloro-6-oxido-3-oxo-3H-xanthen-9-yl)benzoate,
CID10072180,
2',7'-DICHLOROFLUORESCEINSODIUMSALT,
Disodium 2-(2,7-dichloro-6-oxido-3-oxo-xanthen-9-yl)benzoate,
|
| Complexity | 722 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 3 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 443.954g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 29 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 445.159g/mol |
| Monoisotopic Mass | 443.954g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 89.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number