Basic information
- CAS
71526-83-5- Standard SMILES
CCc1ccc(C(=O)CCCCl)cc1- InChIKey
PTKKOYFXSPTUGB-UHFFFAOYSA-N- Molecular formula
- C12H15ClO
- Average molar mass
- 210.7 g/mol
- Monoisotopic mass
- 210.0811428
Names & identifiers
- Preferred name
- 4-Chloro-4'-ethylbutyrophenone
- IUPAC
- 4-chloro-1-(4-ethylphenyl)butan-1-one
- English name
- 4-chloro-4'-ethylbutyrophenone
- Molecular formula
- C12H15ClO
- Molecular weight
- 210.6999
Names & synonyms
71526-83-54-Chloro-4'-ethylbutyrophenone4-chloro-1-(4-ethylphenyl)butan-1-one4-CHLORO-1-(4-ETHYLPHENYL)-1-BUTANONEEINECS 275-597-6NSC163134SCHEMBL3689140DTXSID902217673-chloropropyl 4-ethylphenyl ketoneAKOS000346089NSC 163134NSC-163134
Show more names
4'-Ethyl-γ-chlorobutyrophenone
NS00037240
Database identifiers
- CAS
71526-83-5- PubChem CID
- 98743
- DTXSID
DTXSID90221767- EC Number
- 275-597-6
- Nikkaji
- J289.198K
Properties
Computed structural properties
- XLogP
- 3.3
- Topological polar surface area
- 17.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 5
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 171
Chemistry & industry
Suppliers1 total
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
Related reactions
2 records
Compound notes
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