Basic information
- CAS
55012-69-6- Standard SMILES
CCc1ccc(C(=O)C(C)(C)Cl)cc1- InChIKey
JRCYBVHLGNUGDA-UHFFFAOYSA-N- Molecular formula
- C12H15ClO
- Average molar mass
- 210.7 g/mol
- Monoisotopic mass
- 210.0811428
Names & identifiers
- Preferred name
- 2-Chloro-1-(4-ethylphenyl)-2-methyl-1-propanone
- IUPAC
- 2-chloro-1-(4-ethylphenyl)-2-methylpropan-1-one
- English name
- 2-Chloro-1-(4-ethylphenyl)-2-methyl-1-propanone
- Molecular formula
- C12H15ClO
- Molecular weight
- 210.7
Names & synonyms
2-CHLORO-1-(4-ETHYLPHENYL)-2-METHYL-1-PROPANONE55012-69-6DTXSID00203554RefChem:258288DTXCID301260451-Propanone, 2-chloro-1-(4-ethylphenyl)-2-methyl-2-chloro-1-(4-ethylphenyl)-2-methylpropan-1-oneSCHEMBL27627345JRCYBVHLGNUGDA-UHFFFAOYSA-NDB-3029112-Chloro-1-(4-ethylphenyl)-2-methyl-1-propanone #
Database identifiers
- CAS
55012-69-6- PubChem CID
- 41284
- DTXSID
DTXSID00203554- Nikkaji
- J105.099K
Properties
Computed structural properties
- XLogP
- 3.6
- Topological polar surface area
- 17.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 3
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 202
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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