Basic information
- CAS
2732-09-4- Standard SMILES
Cc1ccc2nc3c(ccc4ccccc43)c(C=O)c2c1- InChIKey
CLAQKFCRXYBNSM-UHFFFAOYSA-N- Molecular formula
- C19H13NO
- Average molar mass
- 271.3 g/mol
- Monoisotopic mass
- 271.09971404
Names & identifiers
- Preferred name
- Benz(c)acridine-7-carboxaldehyde, 9-methyl-
- IUPAC
- 9-methylbenzo[c]acridine-7-carbaldehyde
- English name
- 9-Methylbenz[c]acridine-7-carbaldehyde
- Molecular formula
- C19H13NO
- Molecular weight
- 271.31
Names & synonyms
2732-09-4Benz(c)acridine-7-carboxaldehyde, 9-methyl-9-Methylbenz[c]acridine-7-carbaldehyde9-methylbenzo[c]acridine-7-carbaldehydeBRN 15786017-Formyl-9-methylbenz(c)acridine9-Methylbenz(c)acridine-7-carboxaldehydeDTXSID201817645-21-09-00333 (Beilstein Handbook Reference)Benz[c]acridine-7-carboxaldehyde, 9-methyl-
Database identifiers
- CAS
2732-09-4- PubChem CID
- 75950
- DTXSID
DTXSID20181764- Nikkaji
- J35.256J
Properties
Computed structural properties
- XLogP
- 4.6
- Topological polar surface area
- 30 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 395
Physicochemical properties
- Boiling point
- 414.4 °C · 414.4°C (rough estimate)
- Density
- 1.1363 · 1.1363 (rough estimate)
- refractive index
- 1.5 · 1.5000 (estimate)
- pka
- 1.55 · 1.55±0.30(Predicted)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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