Basic information
- CAS
21629-01-6- Standard SMILES
CN(C)c1ccc2cc3ccc(N(C)C)cc3[n+](C)c2c1- InChIKey
YKPPAAHACUEQSE-UHFFFAOYSA-N- Molecular formula
- C18H22N3+
- Average molar mass
- 280.4 g/mol
- Monoisotopic mass
- 280.18137272
Names & identifiers
- Preferred name
- Acridinium, 3,6-bis(dimethylamino)-10-methyl-
- IUPAC
- 3-N,3-N,6-N,6-N,10-pentamethylacridin-10-ium-3,6-diamine
- English name
- 10-Methyl-3,6-bis(dimethylamino)acridine-10-ium
- Molecular formula
- C18H22N3+
- Molecular weight
- 280.39
Names & synonyms
21629-01-63,6-BIS(DIMETHYLAMINO)-10-METHYLACRIDIN-10-IUMACRIDINIUM, 3,6-BIS(DIMETHYLAMINO)-10-METHYL-10-Methylacridinium orangeBRN 39116453-N,3-N,6-N,6-N,10-pentamethylacridin-10-ium-3,6-diamine10-Methyl-3,6-bis(dimethylamino)acridine-10-iumSCHEMBL8430266DTXSID4017601610-Methylacridine orange3,6-Bis(dimethylamino)-10-methylacridinium
Database identifiers
- CAS
21629-01-6- PubChem CID
- 30718
- DTXSID
DTXSID40176016- Nikkaji
- J55.114G
Properties
Computed structural properties
- XLogP
- 3.9
- Topological polar surface area
- 10.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 21
- Formal charge
- 1
- Complexity
- 322
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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