Basic information
- CAS
302904-42-3- Standard SMILES
Cc1ccc(OS(=O)(=O)c2ccc3c(c2)Cc2cc(S(=O)(=O)Oc4ccc(C)cc4)ccc2-3)cc1- InChIKey
GYNHKNYUTBUIPN-UHFFFAOYSA-N- Molecular formula
- C27H22O6S2
- Average molar mass
- 506.6 g/mol
- Monoisotopic mass
- 506.08578076
Names & identifiers
- Preferred name
- Bis(4-methylphenyl) 9H-fluorene-2,7-disulfonate
- IUPAC
- bis(4-methylphenyl) 9H-fluorene-2,7-disulfonate
Names & synonyms
bis(4-methylphenyl) 9H-fluorene-2,7-disulfonate302904-42-3RefChem:568916663-916-5Di-p-tolyl 9H-fluorene-2,7-disulfonateAKOS000581666Di-p-tolyl9H-fluorene-2,7-disulfonateST50226655Z567970174-methylphenyl 7-[(4-methylphenyl)oxysulfonyl]fluorene-2-sulfonate
Database identifiers
- CAS
302904-42-3- PubChem CID
- 2136123
- EC Number
- 663-916-5
Properties
Computed structural properties
- XLogP
- 6.5
- Topological polar surface area
- 104 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 6
- Heavy atoms
- 35
- Formal charge
- 0
- Complexity
- 844
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
Warning
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P264, P270, P273, P301+P317, P330, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 38 reports by companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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