HRID 1298736As catalystHigh-throughput exploration of 50,688 Pd-, Ni- and Cu-catalysed C–N coupling reactions
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Basic information
- CAS
739-58-2- Standard SMILES
CN(C)c1ccc(P(c2ccccc2)c2ccccc2)cc1- InChIKey
GOEGBJDTWXTPHP-UHFFFAOYSA-N- Molecular formula
- C20H20NP
- Average molar mass
- 305.361 g/mol
- Monoisotopic mass
- 305.13333627
Names & identifiers
- Preferred name
- 4-(Dimethylamino)phenyldiphenylphosphine
- IUPAC
- 4-(Diphenylphosphanyl)-N,N-dimethylaniline
- English name
- 4-(DIMETHYLAMINO)PHENYLDIPHENYLPHOSPHINE
- Molecular formula
- C20H20NP
- Molecular weight
- 305.35
Names & synonyms
TricyclohexylphosphoniuM4-(Diphenylphosphanyl)-N,N-dimethylaniline4-(DIMETHYLAMINO)TRIPHENYLPHOSPHINE4-(Diphenylphosphanyl)-N,N-dimethylanil(Diphenylphosphino)-N,N-dimethylaniline4-(DIMETHYLAMINO)PHENYLDIPHENYLPHOSPHINE4-(DIPHENYLPHOSPHINO)-N,N-DIMETHYLANILINE4-(Dimethylamino)phenyldiphenylphosphine>4-(Dimethylamino)phenyldiphenylphosphine 95%4-(tetramethylamine) phenyldiphenylphosphine
Database identifiers
- CAS
739-58-2- PubChem CID
- 3333592
- DTXSID
DTXSID90391555- ChEMBL
CHEMBL183741- EC Number
- 626-713-2
- Nikkaji
- J711.067G
Properties
Physicochemical properties
- Melting point
- 151 · 151-154 °C (lit.)
- Boiling point
- 417.5 · 417.5±28.0 °C(Predicted)
- storage temp.
- Inert atmosphere,Room Temperature
- form
- solid
- pka
- 4.2 · 4.20±0.12(Predicted)
- color
- white
- Sensitive
- air sensitive
- BRN
- 916331 · 916331
- InChI
- 1S/C20H20NP/c1-21(2)17-13-15-20(16-14-17)22(18-9-5-3-6-10-18)19-11-7-4-8-12-19/h3-16H,1-2H3
- InChIKey
- GOEGBJDTWXTPHP-UHFFFAOYSA-N
- SMILES
- CN(C)c1ccc(cc1)P(c2ccccc2)c3ccccc3
- CAS DataBase Reference
- 739 · 739-58-2
- UNSPSC Code
- 12352116 · 12352116
- NACRES
- 22 · NA.22
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 315 · H315-H319-H335
- Precautionary statements
- 261 · P261-P264-P271-P280-P302+P352-P305+P351+P338
- target organs
- Respiratory system
- PPE
- 95 · dust mask type N95 (US), Eyeshields, Gloves
- Hazard Codes
- Xi
- Risk Statements
- 36 · 36/37/38
- Safety Statements
- 26 · 26-36
- WGK Germany
- 3 · 3
- TSCA
- No
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- PPE
- dust mask type N95 (US), Eyeshields, Gloves
- wgk
- 3
- tsca
- No
- hs_code
- 29319090
- risk_code
- 36/37/38
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xi
- safety_code
- 26-36
- Storage Class
- 11 - Combustible Solids
- target organs
- Respiratory system
- Hazard statements
- H315-H319-H335
- Hazard Classifications
- Eye Irrit. 2Skin Irrit. 2STOT SE 3
- Precautionary statements
- P261-P264-P271-P280-P302+P352-P305+P351+P338
Chemistry & industry
Applications
UsesCatalyst for:Preparation of dicyano(aryl)cyclohexenecarboxylic acid esters via regioselective annulationDiastereoselective cycloaddition of styrenyl allenoatesInterfacial carbonylation of methylbenzyl bromideHydroformylation of octeneReducing agent for selectivity of disulfide-internally linked peptide-nucleic acid cleavage
Upstream & downstream products
Upstream raw materials
Suppliers100 total
梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
湖南韵邦生物科技股份有限公司0731-88532326 13319508186 · [email protected]
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
上海麦克林生化科技股份有限公司021-50706066 15221275939 · [email protected]
Related reactions
129 records
HRID 1298737As catalystHigh-throughput exploration of 50,688 Pd-, Ni- and Cu-catalysed C–N coupling reactions
HRID 1298738As catalystHigh-throughput exploration of 50,688 Pd-, Ni- and Cu-catalysed C–N coupling reactions
HRID 1298739As catalystHigh-throughput exploration of 50,688 Pd-, Ni- and Cu-catalysed C–N coupling reactions
HRID 1298740As catalystHigh-throughput exploration of 50,688 Pd-, Ni- and Cu-catalysed C–N coupling reactions
HRID 1298741As catalystHigh-throughput exploration of 50,688 Pd-, Ni- and Cu-catalysed C–N coupling reactions
HRID 1298742As catalystHigh-throughput exploration of 50,688 Pd-, Ni- and Cu-catalysed C–N coupling reactions
HRID 1298743As catalystHigh-throughput exploration of 50,688 Pd-, Ni- and Cu-catalysed C–N coupling reactions
Compound notes
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