5-Chloro-2-(diphenylphosphoryl)pentanoic acid
Basic information
- CAS
329266-68-4- Standard SMILES
O=C(O)C(CCCCl)P(=O)(c1ccccc1)c1ccccc1- InChIKey
CDMHMQKREXVPPN-UHFFFAOYSA-N- Molecular formula
- C17H18ClO3P
- Average molar mass
- 336.7 g/mol
- Monoisotopic mass
- 336.0682091
Names & identifiers
- Preferred name
- 5-Chloro-2-(diphenylphosphoryl)pentanoic acid
- IUPAC
- 5-chloro-2-diphenylphosphorylpentanoic acid
Names & synonyms
5-chloro-2-(diphenylphosphoryl)pentanoic acidDTXSID601251113STL331269AKOS001019540AKOS022139785329266-68-4UPCMLD0ENAT0504-4674:0015-Chloro-2-(diphenylphosphinyl)pentanoic acidZ56794693
Database identifiers
- CAS
329266-68-4- PubChem CID
- 4593665
- DTXSID
DTXSID601251113
Properties
Computed structural properties
- XLogP
- 3.4
- Topological polar surface area
- 54.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 7
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 379
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Compound notes
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