Basic information
- Standard SMILES
CC(C)Oc1cccc(OC(C)C)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.NCCc1[c-]cccc1.[Cl-].[Pd+2]- InChIKey
ZBIAIXFGBSQSTB-UHFFFAOYSA-M- Molecular formula
- C38H53ClNO2PPd
- Average molar mass
- 728.7 g/mol
Names & identifiers
- Preferred name
- Dicyclohexyl-[2-(2,6-diisopropoxyphenyl)phenyl]phosphane palladium(2+) 2-phenylethanamine chloride
- IUPAC
- dicyclohexyl-[2-[2,6-di(propan-2-yloxy)phenyl]phenyl]phosphane;palladium(2+);2-phenylethanamine;chloride
Names & synonyms
dicyclohexyl-[2-(2,6-diisopropoxyphenyl)phenyl]phosphane palladium(2+) 2-phenylethanamine chloride
Database identifiers
- CAS
1028206-60-1- PubChem CID
- 177838722
Properties
Computed structural properties
- Topological polar surface area
- 44.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 10
- Heavy atoms
- 44
- Formal charge
- 0
- Complexity
- 679
Related reactions
1 records
Linked notes
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