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212713-08-1

212713-08-1 Structure

212713-08-1 Structure
IdentificationBack Directory
[Name]

BIS(3,5-DI-TERT-BUTYL-4-METHOXYPHENYL)CHLOROPHOSPHINE
[CAS]

212713-08-1
[Synonyms]

Bis(3,5-di-t-butyl-4-methoxyphenyl)chlorophosphine,
BIS(3,5-DI-TERT-BUTYL-4-METHOXYPHENYL)CHLOROPHOSPHINE
chloro-bis(3,5-ditert-butyl-4-methoxyphenyl)phosphane
Bis(3,5-di-t-butyl-4-methoxyphenyl)chlorophosphine,93%
BIS(3,5-DI-TERT-BUTYL-4-METHOXYPHENYL)PHOSPHINOUS CHLORIDE
Bis[3,5-bis(1,1-dimethylethyl)-4-methoxyphenyl]phosphinous chloride
Phosphinous chloride, P,P-bis[3,5-bis(1,1-dimethylethyl)-4-methoxyphenyl]-
[EINECS(EC#)]

633-650-4
[Molecular Formula]

C30H46ClO2P
[MDL Number]

MFCD08458881
[MOL File]

212713-08-1.mol
[Molecular Weight]

505.11
Chemical PropertiesBack Directory
[Melting point ]

116-120 °C
[Boiling point ]

552.5±50.0 °C(Predicted)
[form ]

solid
[Water Solubility ]

Reacts with water.
[Sensitive ]

Air & Moisture Sensitive
[InChI]

1S/C30H46ClO2P/c1-27(2,3)21-15-19(16-22(25(21)32-13)28(4,5)6)34(31)20-17-23(29(7,8)9)26(33-14)24(18-20)30(10,11)12/h15-18H,1-14H3
[InChIKey]

VOGHMZHRQUWLRE-UHFFFAOYSA-N
[SMILES]

COc1c(cc(cc1C(C)(C)C)P(Cl)c2cc(c(OC)c(c2)C(C)(C)C)C(C)(C)C)C(C)(C)C
Safety DataBack Directory
[Symbol(GHS) ]

Flame (GHS02)
GHS02
[Signal word ]

Warning
[Hazard statements ]

H228
[Precautionary statements ]

P210
[Hazard Codes ]

F
[Risk Statements ]

11
[RIDADR ]

UN3261
[WGK Germany ]

3
[HazardClass ]

8
[PackingGroup ]

II
[Storage Class]

4.1B - Flammable solid hazardous materials
[Hazard Classifications]

Flam. Sol. 2
Hazard InformationBack Directory
[Uses]

It is used as a reactant for asymmetric hydrogenation with iridium catalysts, chemo selective reaction with deprotonated 2-hydoxy-3,3,N-trimethylbutanamide. It is also used as a reactant for synthesis of phosphine- containing amino acids and peptide-based catalyst ligands, nonracemic phosphine-containing amino acids for palladium- catalyzed asymmetric allylic substitution reactions.
[reaction suitability]

reaction type: Buchwald-Hartwig Cross Coupling Reaction
reaction type: Heck Reaction
reaction type: Hiyama Coupling
reaction type: Negishi Coupling
reaction type: Sonogashira Coupling
reaction type: Stille Coupling
reaction type: Suzuki-Miyaura Coupling
reagent type: ligand
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