Basic information
- CAS
5796-93-0- Standard SMILES
O=c1ccc2c3ccc(=O)c4cccc(c5cccc1c52)c43- InChIKey
FUTARTAINOHELR-UHFFFAOYSA-N- Molecular formula
- C20H10O2
- Average molar mass
- 282.3 g/mol
- Monoisotopic mass
- 282.06807956
Names & identifiers
- Preferred name
- 3,10-Perylenedione
- IUPAC
- perylene-3,10-dione
- English name
- Perylene-3,10-dione
- Molecular formula
- C20H10O2
- Molecular weight
- 282.29
Names & synonyms
3,10-Perylenedione3,10-Perylenequinone9P6F78UQJ1NSC 105560NSC-105560UNII-9P6F78UQJ1DTXSID50206676RefChem:90557DTXCID801291675796-93-0Perylene-3,10-dioneNSC105560
Show more names
perylene-3,10-quinone3,10-Perylenequinone-CHEMBL93007SCHEMBL4822698AKOS004907051DS-013883
Database identifiers
- CAS
5796-93-0- PubChem CID
- 97194
- DTXSID
DTXSID50206676- ChEMBL
CHEMBL93007- UNII
- 9P6F78UQJ1
- Nikkaji
- J13.382E
Properties
Computed structural properties
- XLogP
- 4.4
- Topological polar surface area
- 34.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 535
Physicochemical properties
- FDA UNII
- 9 P6F78UQJ1 · 9P6F78UQJ1
Chemistry & industry
Suppliers2 total
郑州汇聚化工有限公司037155153829 18003835034 · [email protected]
吉林中科研伸科技有限公司043180534350 19917294565 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…