Basic information
- Standard SMILES
CS(=O)(=O)c1ccc([C@@H](CC2CCCC2)C(=O)O)cc1Cl- InChIKey
NVODVFUXRXQBQK-GFCCVEGCSA-N- Molecular formula
- C15H19ClO4S
- Average molar mass
- 330.8 g/mol
Names & identifiers
- Preferred name
- (R)-2-(3-Chloro-4-(methylsulfonyl)phenyl)-3-cyclopentylpropanoic acid
- IUPAC
- (2R)-2-(3-chloro-4-methylsulfonylphenyl)-3-cyclopentylpropanoic acid
Names & synonyms
300356-14-3(R)-2-(3-CHLORO-4-(METHYLSULFONYL)PHENYL)-3-CYCLOPENTYLPROPANOIC ACIDSCHEMBL1171463NVODVFUXRXQBQK-GFCCVEGCSA-N2(R)-(3-chloro-4-methanesulfonyl-phenyl)-3-cyclopentyl -propionic acid2(R)-(3-chloro-4-methanesulfonyl-phenyl)-3-cyclopentyl-propionic acid2(R)-(3chloro-4-methanesulfonyl-phenyl)-3-cyclopentyl-propionic acid(R)-2-(3-CHLORO-4-(METHYLSULFONYL)PHENYL)-3-CYCLOPENTYLPROPANOICACID
Database identifiers
- PubChem CID
- 12067655
Properties
Computed structural properties
- XLogP
- 3.8
- Topological polar surface area
- 79.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 465
Related reactions
89 records
Linked notes
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