1-(4-Ethoxyphenyl)-2-methylpropan-1-one
Basic information
- CAS
72846-63-0- Standard SMILES
CCOc1ccc(C(=O)C(C)C)cc1- InChIKey
POGPSKUWSGOZRN-UHFFFAOYSA-N- Molecular formula
- C12H16O2
- Average molar mass
- 192.25 g/mol
- Monoisotopic mass
- 192.11502975
Names & identifiers
- Preferred name
- 1-(4-Ethoxyphenyl)-2-methylpropan-1-one
- IUPAC
- 1-(4-ethoxyphenyl)-2-methylpropan-1-one
- English name
- 1-(4-ethoxyphenyl)-2-methylpropan-1-one
- Molecular formula
- C12H16O2
- Molecular weight
- 192.25
Names & synonyms
72846-63-01-(4-Ethoxyphenyl)-2-methylpropan-1-one4'-Ethoxy-2-methylpropiophenone1-(4-Ethoxyphenyl)-2-methyl-1-propanoneMFCD112051171-Propanone, 1-(4-ethoxyphenyl)-2-methyl-1-(4-ethoxyphenyl)-2-methyl-propan-1-oneSCHEMBL14085715DTXSID20459399AKOS000346044AS-84232SY283705
Show more names
CS-0363639E77751F396868
Database identifiers
- CAS
72846-63-0- PubChem CID
- 11229293
- DTXSID
DTXSID20459399
Properties
Computed structural properties
- XLogP
- 3
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 179
Physicochemical properties
- Boiling point
- 297.8 · 297.8±13.0 °C(Predicted)
- Density
- 0.986 · 0.986±0.06 g/cm3(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 280 · P280-P305+P351+P338
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
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P280-P305+P351+P338
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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