(S)-α,α-Bis[3,5-bis(trifluoromethyl)phenyl]-2-pyrrolidinemethanol trimethylsilyl ether - ≥97% , CAS No.848821-61-4

CAS: 848821-61-4 Cat. No.: S469737 Peso molecular: 597.52 Número EC: 628-093-9 PubChem CID: 11284830

GRADE & PURITY ≥97%

Synonyms

(S)-,-Bis[3,5-bis(trifluoromethyl)phenyl]-2-pyrrolidinemethanol trimethylsilyl ether | MOHRGTBNEJKFMB-IBGZPJMESA-N | A863938 | (S)-ALPHA,ALPHA-BIS(3,5-BIS(TRIFLUOROMET | AS-42927 | (S)-ALPHA,ALPHA-BIS(3,5-BIS(TRIFLUOROMETHYL)PHENYL)-2-PYRROLIDINEMETHANOL

Storage

Store at 2-8°C,Protected from light,Argon charged

Shipped In

Wet ice

Descripción general

(S)-α,α-Bis[3,5-bis(trifluoromethyl)phenyl]-2-pyrrolidinemethanol trimethylsilyl ether is a diarylprolinol silyl ether organocatalyst. It can catalyze a variety of bond-forming reactions such as C-C, C-N, C-O, C-S, and C-Hal in high yields and excellent levels of enantiocontrol.

Specifications

Sinónimos

(S)-, -Bis[3, 5-bis(trifluoromethyl)phenyl]-2-pyrrolidinemethanol trimethylsilyl ether | MOHRGTBNEJKFMB-IBGZPJMESA-N | A863938 | (S)-ALPHA, ALPHA-BIS(3, 5-BIS(TRIFLUOROMET | AS-42927 | (S)-ALPHA, ALPHA-BIS(3, 5-BIS(TRIFLUOROMETHYL)PHENYL)-2-PYRROLIDINEMETHANOL

Especificaciones y pureza

≥97%

Condiciones de almacenamiento de almacenamiento

Store at 2-8°C, Protected from light, Argon charged

Enviado en

Wet ice

Este producto requiere envío en cadena de frío. Los servicios terrestres y otros servicios económicos no están disponibles.

Pureza

≥97%

Nombres e identificadores

• Pubchem Sid: 504766244
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/504766244
• Sonrisas canónicas: C[Si](C)(C)OC(C1CCCN1)(C2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F)C3=CC(=CC(=C3)C(F)(F)F)C(F)(F)F
• IUPAC Name: [bis[3,5-bis(trifluoromethyl)phenyl]-[(2S)-pyrrolidin-2-yl]methoxy]-trimethylsilane
• InChIKey: MOHRGTBNEJKFMB-IBGZPJMESA-N
• INCHI: 1S/C24H23F12NOSi/c1-39(2,3)38-20(19-5-4-6-37-19,13-7-15(21(25,26)27)11-16(8-13)22(28,29)30)14-9-17(23(31,32)33)12-18(10-14)24(34,35)36/h7-12,19,37H,4-6H2,1-3H3/t19-/m0/s1
• Isómeros SMILES: C[Si](C)(C)OC([C@@H]1CCCN1)(C2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F)C3=CC(=CC(=C3)C(F)(F)F)C(F)(F)F
• PubChem CID: 11284830
• Peso molecular: 597.52

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • Clase Benzene and substituted derivatives
      • Subclass Diphenylmethanes

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Clase: Benzene and substituted derivatives
• Subclass: Diphenylmethanes
• Intermediate Tree Nodes: Not available
• Direct Parent: Diphenylmethanes
• Alternative Parents: Trifluoromethylbenzenes Aralkylamines Trialkylheterosilanes Pyrrolidines Silyl ethers Organic metalloid salts Dialkylamines Azacyclic compounds Organooxygen compounds Organofluorides Hydrocarbon derivatives Alkyl fluorides
• Molecular Framework: Aromatic heteromonocyclic compounds
• Substituents: Diphenylmethane - Trifluoromethylbenzene - Aralkylamine - Pyrrolidine - Trialkylheterosilane - Silyl ether - Secondary aliphatic amine - Secondary amine - Organoheterosilane - Organoheterocyclic compound - Organic metalloid salt - Azacycle - Alkyl halide - Organic oxygen compound - Organooxygen compound - Organonitrogen compound - Organofluoride - Organic metalloid moeity - Organohalogen compound - Organosilicon compound - Amine - Hydrocarbon derivative - Alkyl fluoride - Organic nitrogen compound - Aromatic heteromonocyclic compound
• Descripción: This compound belongs to the class of organic compounds known as diphenylmethanes. These are compounds containing a diphenylmethane moiety, which consists of a methane wherein two hydrogen atoms are replaced by two phenyl groups.
• External Descriptors: Not available

Data sources

1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61.

DOI: 10.1186/s13321-016-0174-y

Propiedades químicas y físicas

• Sensibilidad: Air and moisture sensitive
• Peso molecular: 597.500 g/mol
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 14
• Rotatable Bond Count: 5
• Exact Mass: 597.136 Da
• Monoisotopic Mass: 597.136 Da
• Topological Polar Surface Area: 21.300 Ų
• Heavy Atom Count: 39
• Formal Charge: 0
• Complexity: 737.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 1
• Undefined Atom Stereocenter Count: 0
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 0
• Covalently-Bonded Unit Count: 1

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