Basic information
- CAS
125419-41-2- Standard SMILES
CCN(CC)c1ccc2c(C)cc(=[NH+]Cc3ccccc3)oc2c1- InChIKey
AEIQVQSSGKUJLF-UHFFFAOYSA-N- Molecular formula
- C21H25N2O+
- Average molar mass
- 321.4 g/mol
- Monoisotopic mass
- 321.19668843
Names & identifiers
- Preferred name
- 2-Benzylamino-4-methyl-7-diethylaminobenzopyrylium monotetrafluoroborate
- IUPAC
- benzyl-[7-(diethylamino)-4-methylchromen-2-ylidene]azanium
- English name
- 2-benzylamino-4-methyl-7-diethylaminobenzopyrylium
- Molecular weight
- 0
Names & synonyms
125419-41-22-Benzylamino-4-methyl-7-diethylaminobenzopyrylium monotetrafluoroborate2-benzylamino-4-methyl-7-diethylaminobenzopyrylium
Database identifiers
- CAS
125419-41-2- PubChem CID
- 130445
Properties
Computed structural properties
- XLogP
- 4.5
- Topological polar surface area
- 26.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 5
- Heavy atoms
- 24
- Formal charge
- 1
- Complexity
- 460
Chemistry & industry
Suppliers1 total
济南思考化学有限公司0531-0000 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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