Basic information
- CAS
2700-03-0- Standard SMILES
O=C(O)CCC1(Cc2ccc(Cl)cc2)CCCC1=O- InChIKey
CVCBVBHCHPDVHA-UHFFFAOYSA-N- Molecular formula
- C15H17ClO3
- Average molar mass
- 280.74 g/mol
- Monoisotopic mass
- 280.0866221
Names & identifiers
- Preferred name
- Cyclopentanepropionic acid, 1-(p-chlorophenyl)-2-oxo-
- IUPAC
- 3-[1-[(4-chlorophenyl)methyl]-2-oxocyclopentyl]propanoic acid
- English name
- 3-[1-[(4-chlorophenyl)methyl]-2-oxo-cyclopentyl]propanoic acid
- Molecular formula
- C15H17ClO3
- Molecular weight
- 280.75
Names & synonyms
BRN 27446221-(p-Chlorobenzyl)-2-oxocyclopentanepropionic acid2700-03-0Cyclopentanepropionic acid, 1-(p-chlorophenyl)-2-oxo-Acido 2-(p-clorobenzil)ciclopentanon-2-beta-propionico [Italian]Acido 2-(p-clorobenzil)ciclopentanon-2-beta-propionicoRefChem:336004DTXSID709497753-{1-[(4-CHLOROPHENYL)METHYL]-2-OXOCYCLOPENTYL}PROPANOIC ACID3-[1-[(4-CHLOROPHENYL)METHYL]-2-OXO-CYCLOPENTYL]PROPANOIC ACID1-(p-Chlorophenylmethyl)-2-oxocyclopentanepropionic acidCyclopentanepropanoic acid, 1-[(4-chlorophenyl)methyl]-2-oxo-
Database identifiers
- CAS
2700-03-0- PubChem CID
- 200779
- DTXSID
DTXSID70949775- Nikkaji
- J77.972E
Properties
Computed structural properties
- XLogP
- 2.7
- Topological polar surface area
- 54.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 347
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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