2,3,4-Triethoxybenzophenone
Basic information
- CAS
480439-31-4- Standard SMILES
CCOc1ccc(C(=O)c2ccccc2)c(OCC)c1OCC- InChIKey
LILFYPQSUSYNGF-UHFFFAOYSA-N- Molecular formula
- C19H22O4
- Average molar mass
- 314.4 g/mol
- Monoisotopic mass
- 314.15180918
Names & identifiers
- Preferred name
- 2,3,4-Triethoxybenzophenone
- IUPAC
- phenyl-(2,3,4-triethoxyphenyl)methanone
- English name
- 2 3 4-Triethoxybenzophenone 97
- Molecular formula
- C19H22O4
- Molecular weight
- 314.38
Names & synonyms
Phenyl(2,3,4-triethoxyphenyl)methanone2,3,4-Triethoxybenzophenone480439-31-4SCHEMBL11695549SCHEMBL29985877DTXSID803919882 3 4-Triethoxybenzophenone 97Methanone, phenyl(2,3,4-triethoxyphenyl)-
Database identifiers
- CAS
480439-31-4- PubChem CID
- 3384352
- DTXSID
DTXSID80391988
Properties
Computed structural properties
- XLogP
- 4.3
- Topological polar surface area
- 44.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 8
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 351
Physicochemical properties
- Density
- 1.098 g/mL · 1.098 g/mL at 25 °C(lit.)
- refractive index
- 20 · n20/D 1.5600(lit.)
- Flash point
- 230 °F · >230 °F
- WGK Germany
- 3 · 3
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- wgk
- 3
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Related reactions
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Compound notes
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