Basic information
- CAS
58851-76-6- Standard SMILES
CC(=O)Oc1ccc(OC(C)=O)c2c1CC=CC2- InChIKey
XVBYYBJLKRDWRZ-UHFFFAOYSA-N- Molecular formula
- C14H14O4
- Average molar mass
- 246.26 g/mol
- Monoisotopic mass
- 246.08920892
Names & identifiers
- Preferred name
- 5,8-Dihydronaphthalene-1,4-diyl diacetate
- IUPAC
- (4-acetyloxy-5,8-dihydronaphthalen-1-yl) acetate
Names & synonyms
5,8-dihydronaphthalene-1,4-diyl diacetate58851-76-64-(ACETYLOXY)-5,8-DIHYDRONAPHTHALEN-1-YL ACETATENSC23820SCHEMBL11605568DTXSID10282012NSC-23820
Database identifiers
- CAS
58851-76-6- PubChem CID
- 229822
- DTXSID
DTXSID10282012
Properties
Computed structural properties
- XLogP
- 2.5
- Topological polar surface area
- 52.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 327
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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