Chrysen-6-yl acetate
Basic information
- CAS
7499-59-4- Standard SMILES
CC(=O)Oc1cc2c3ccccc3ccc2c2ccccc12- InChIKey
BAJJIGXNQPFIEO-UHFFFAOYSA-N- Molecular formula
- C20H14O2
- Average molar mass
- 286.3 g/mol
- Monoisotopic mass
- 286.09937969
Names & identifiers
- Preferred name
- Chrysen-6-yl acetate
- IUPAC
- chrysen-6-yl acetate
Names & synonyms
chrysen-6-yl acetate7499-59-4NSC407627DTXSID60324739NSC-407627
Database identifiers
- CAS
7499-59-4- PubChem CID
- 348357
- DTXSID
DTXSID60324739- Nikkaji
- J638.266E
Properties
Computed structural properties
- XLogP
- 5.3
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 418
Suppliers
Loading…
Open inquiries
Loading…
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…