Basic information
- CAS
99107-53-6- Standard SMILES
COc1c(-c2ccccc2)c(-c2ccccc2)c(OC(C)=O)c2ccccc12- InChIKey
SGAMBYIRMSQESI-UHFFFAOYSA-N- Molecular formula
- C25H20O3
- Average molar mass
- 368.4 g/mol
- Monoisotopic mass
- 368.1412445
Names & identifiers
- Preferred name
- 1-Naphthalenol, 4-methoxy-2,3-diphenyl-, 1-acetate
- IUPAC
- (4-methoxy-2,3-diphenylnaphthalen-1-yl) acetate
Names & synonyms
99107-53-61-Naphthalenol, 4-methoxy-2,3-diphenyl-, 1-acetateDTXSID30243948RefChem:76525DTXCID601664394-methoxy-2,3-diphenylnaphthalen-1-yl acetateCHEMBL424187
Database identifiers
- CAS
99107-53-6- PubChem CID
- 188486
- DTXSID
DTXSID30243948- ChEMBL
CHEMBL424187- Nikkaji
- J273.576H
Properties
Computed structural properties
- XLogP
- 6.1
- Topological polar surface area
- 35.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 506
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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