Xanthylium, 3,6-bis(diethylamino)-, perchlorate (1:1)
Basic information
- CAS
62669-69-6- Standard SMILES
CCN(CC)c1ccc2cc3ccc(=[N+](CC)CC)cc-3oc2c1.[O-][Cl+3]([O-])([O-])[O-]- InChIKey
UYOSCERBTRLUNZ-UHFFFAOYSA-M- Molecular formula
- C21H27ClN2O5
- Average molar mass
- 422.9 g/mol
- Monoisotopic mass
- 422.1608497
Names & identifiers
- Preferred name
- Xanthylium, 3,6-bis(diethylamino)-, perchlorate (1:1)
- IUPAC
- [6-(diethylamino)xanthen-3-ylidene]-diethylazanium perchlorate
Names & synonyms
Xanthylium, 3,6-bis(diethylamino)-, perchlorate62669-69-6DTXSID6069618Xanthylium, 3,6-bis(diethylamino)-, perchlorate (1:1)RefChem:195193DTXCID5043471UYOSCERBTRLUNZ-UHFFFAOYSA-M3,6-Bis(diethylamino)xanthen-10-ium perchlorate
Database identifiers
- CAS
62669-69-6- PubChem CID
- 65216
- DTXSID
DTXSID6069618
Properties
Computed structural properties
- Topological polar surface area
- 89.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 5
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 625
Chemistry & industry
Uses & manufacturing
General Manufacturing InformationXanthylium, 3,6-bis(diethylamino)-, perchlorate (1:1): INACTIVE
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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