Basic information
- CAS
52886-92-7- Standard SMILES
CCOc1ccc(C(=O)c2ccc(OC)cc2)cc1- InChIKey
DXFSDXPGMHHSDI-UHFFFAOYSA-N- Molecular formula
- C16H16O3
- Average molar mass
- 256.3 g/mol
- Monoisotopic mass
- 256.10994437
Names & identifiers
- Preferred name
- Benzophenone, 4-ethoxy-4'-methoxy-
- IUPAC
- (4-ethoxyphenyl)-(4-methoxyphenyl)methanone
- English name
- (4-ETHOXYPHENYL)(4-METHOXYPHENYL)METHANONE
- Molecular formula
- C16H16O3
- Molecular weight
- 256.3
Names & synonyms
52886-92-7BENZOPHENONE, 4-ETHOXY-4'-METHOXY-4-Ethoxy-4'-methoxybenzophenoneBRN 2375913Methanone, (4-ethoxyphenyl)(4-methoxyphenyl)-DTXSID202009294-08-00-02454 (Beilstein Handbook Reference)RefChem:328150DTXCID00123420(4-ethoxyphenyl)(4-methoxyphenyl)methanone(4-ethoxyphenyl)-(4-methoxyphenyl)methanone(4-Ethoxy-phenyl)-(4-methoxy-phenyl)-methanone
Show more names
MFCD01662327SCHEMBL11576081DB-309986
Database identifiers
- CAS
52886-92-7- PubChem CID
- 40569
- DTXSID
DTXSID20200929
Properties
Computed structural properties
- XLogP
- 3.6
- Topological polar surface area
- 35.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 274
Physicochemical properties
- Melting point
- 112 · 112–113°C
Chemistry & industry
Preparation methods
PreparationObtained by reaction of p-anisoyl chloride with phenetole in the presence of aluminium chloride in carbon disulfide.
Suppliers1 total
珠海奥博凯生物医药技术有限公司400-0628126 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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