4-(9H-Xanthen-9-yl)-phenylamine
Basic information
- CAS
6630-82-6- Standard SMILES
Nc1ccc(C2c3ccccc3Oc3ccccc32)cc1- InChIKey
BQZSDBAYXAUODK-UHFFFAOYSA-N- Molecular formula
- C19H15NO
- Average molar mass
- 273.3 g/mol
- Monoisotopic mass
- 273.1153641
Names & identifiers
- Preferred name
- 4-(9H-Xanthen-9-yl)-phenylamine
- IUPAC
- 4-(9H-xanthen-9-yl)aniline
Names & synonyms
6630-82-64-(9H-Xanthen-9-yl)-phenylamine4-(9H-xanthen-9-yl)anilineNSC55807NCIOpen2_001958SCHEMBL28252707DTXSID40288426NSC-55807AKOS000601512
Database identifiers
- CAS
6630-82-6- PubChem CID
- 244709
- DTXSID
DTXSID40288426
Properties
Computed structural properties
- XLogP
- 4.2
- Topological polar surface area
- 35.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 327
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Compound notes
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