4-(Di-tert-butylphosphino)-N,N-dimethylaniline
Product Information
Molecular Formula
C16H28NP
Molecular Weight
265.37
Description
Ligand used to prepare a palladium dichloride catalyst (678740) on treatment with PdCl2(COD). The catalyst effectively cross-couples aryl boronic acids with heteroaryl chlorides.
Synonyms
4-ditert-butylphosphino-N,N-dimethylaniline; 4-ditert-butylphosphanyl-N,N-dimethylaniline
IUPAC Name
4-ditert-butylphosphanyl-N,N-dimethylaniline
SMILES
CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C
InChI
InChI=1S/C16H28NP/c1-15(2,3)18(16(4,5)6)14-11-9-13(10-12-14)17(7)8/h9-12H,1-8H3
InChI Key
IQTHEAQKKVAXGV-UHFFFAOYSA-N
Melting Point
57-61 °C
Flash Point
Not applicable
Purity
95 %
Storage
Keep in dark place, Inert atmosphere, Room temperature
LogP
4.45680
Safety Information
Hazards
H314
Precautionary Statement
P260, P261, P264, P271, P280, P301+P330+P331, P302+P352, P303+P361+P353, P304+P340, P305+P351+P338, P310, P312, P321, P332+P313, P337+P313, P362, P363, P403+P233, P405, and P501
Signal Word
Danger
Computed Properties
XLogP3
3.6
Hydrogen Bond Donor Count
0
Hydrogen Bond Acceptor Count
1
Rotatable Bond Count
4
Exact Mass
265.195936895 g/mol
Monoisotopic Mass
265.195936895 g/mol
Topological Polar Surface Area
3.2Ų
Heavy Atom Count
18
Formal Charge
0
Complexity
237
Isotope Atom Count
0
Defined Atom Stereocenter Count
0
Undefined Atom Stereocenter Count
0
Defined Bond Stereocenter Count
0
Undefined Bond Stereocenter Count
0
Covalently-Bonded Unit Count
1
Compound Is Canonicalized
Yes
Patents
| Publication Number | Title | Priority Date |
|---|---|---|
| CN-113200957-A | Acid/alkali dye co-sensitization system and preparation method and application thereof | 2021-04-09 |
| CN-113200957-B | Acid/alkali dye co-sensitization system and preparation method and application thereof | 2021-04-09 |
| CN-113024365-A | Industrial production method of benzo [ c ] phenanthrene-5-trifluoromethanesulfonate | 2021-03-12 |
| CN-113845478-A | Intermediate, preparation method and application thereof | 2020-12-18 |
| CN-114163455-A | Compound, composition, liquid crystal composition, and liquid crystal display element or light control element | 2020-09-10 |
| US-2022073750-A1 | Dichroic dye and liquid crystal composition | 2020-09-10 |
| WO-2022050385-A1 | Phenol derivative | 2020-09-07 |
| CN-111909217-A | Bis (di-tert-butyl-4-dimethylaminophenylphosphine) tetrabromobiladalladium (II) compound and preparation method and application thereof | 2020-08-20 |
| WO-2022040324-A1 | COMPOUNDS AND METHODS OF MODULATING 17β-ΗYDROXYSTEROID DEHYDROGENASE TYPE 13 | 2020-08-18 |
| WO-2022025174-A1 | Nitrogen-containing heterocyclic compound or salt thereof, use thereof, and intermediate thereof | 2020-07-30 |
Literatures
| PMID | Publication Date | Title | Journal |
|---|---|---|---|
| 1103 | 1975-03-01 | [The fragmentation and reconstruction of the oligomycin-sensitive ATPase system of liver mitochondria] | Biokhimiia (Moscow, Russia) |
