Basic information
- CAS
5454-40-0- Standard SMILES
O=C(O)c1ccc(N=C2c3ccccc3-c3ccccc32)cc1- InChIKey
FSHGEJNHETXXNN-UHFFFAOYSA-N- Molecular formula
- C20H13NO2
- Average molar mass
- 299.3 g/mol
- Monoisotopic mass
- 299.09462866
Names & identifiers
- Preferred name
- 4-(Fluoren-9-ylideneamino)benzoic acid
- IUPAC
- 4-(fluoren-9-ylideneamino)benzoic acid
- English name
- 4-(fluoren-9-ylideneamino)benzoic acid
- Molecular formula
- C20H13NO2
- Molecular weight
- 299.32
Names & synonyms
5454-40-0MLS0026389244-(fluoren-9-ylideneamino)benzoic acidNSC23172CHEMBL1702628DTXSID90281821HMS3093I18NSC-23172SMR0015483864-[(9H-FLUOREN-9-YLIDENE)AMINO]BENZOIC ACIDBenzoic acid, 4-(9H-fluoren-9-ylideneamino)-
Database identifiers
- CAS
5454-40-0- PubChem CID
- 229458
- DTXSID
DTXSID90281821- ChEMBL
CHEMBL1702628
Properties
Computed structural properties
- XLogP
- 4.9
- Topological polar surface area
- 49.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 454
Chemistry & industry
Suppliers1 total
HONEST JOY HOLDINGS LIMITED[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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