Basic information
- CAS
24019-80-5- Standard SMILES
Cc1ccccc1Nc1nc(Nc2ccc(C=Cc3ccc(Nc4nc(Nc5ccccc5C)nc(N5CCOCC5)n4)cc3S(=O)(=O)[O-])c(S(=O)(=O)[O-])c2)nc(N2CCOCC2)n1.[Na+].[Na+]- InChIKey
NPCQBBQZOWVQDB-UHFFFAOYSA-L- Molecular formula
- C42H42N12Na2O8S2
- Average molar mass
- 953 g/mol
- Monoisotopic mass
- 952.24853726
Overview
See other relationships...
Names & identifiers
- Preferred name
- Disodium 4,4'-bis[(4-morpholino-6-o-toluidino-1,3,5-triazin-2-yl)amino]stilbene-2,2'-disulphonate
- IUPAC
- disodium;5-[[4-(2-methylanilino)-6-morpholin-4-yl-1,3,5-triazin-2-yl]amino]-2-[2-[4-[[4-(2-methylanilino)-6-morpholin-4-yl-1,3,5-triazin-2-yl]amino]-2-sulfonatophenyl]ethenyl]benzenesulfonate
Names & synonyms
24019-80-5C.I. FLUORESCENT BRIGHTENER 225SCHEMBL25301062DTXSID10891825Disodium 4,4'-bis[(4-morpholino-6-o-toluidino-1,3,5-triazin-2-yl)amino]stilbene-2,2'-disulphonateDisodium 2,2'-(ethene-1,2-diyl)bis(5-{[4-(2-methylanilino)-6-(morpholin-4-yl)-1,3,5-triazin-2-yl]amino}benzene-1-sulfonate)
Database identifiers
- CAS
24019-80-5- PubChem CID
- 32185
- DTXSID
DTXSID10891825- EC Number
- 245-988-6
Properties
Computed structural properties
- Topological polar surface area
- 282 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 20
- Rotatable bonds
- 12
- Heavy atoms
- 66
- Formal charge
- 0
- Complexity
- 1,570
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…