(N-Boc-2-pyrrolyl)dimethylsilanol - ≥97% , CAS No.879904-82-2

CAS: 879904-82-2 Cat. No.: N469801 Peso molecular: 241.36 Número EC: 677-223-0

GRADE & PURITY ≥97%

Synonyms

tert-butyl 2-[hydroxy(dimethyl)silyl]pyrrole-1-carboxylate | SCHEMBL2176723 | TERT-BUTYL 2-(HYDROXYDIMETHYLSILYL)PYRROLE-1-CARBOXYLATE | N-Boc-2-Hydroxydimethylsilanyl-pyrrole | (N-Boc-2-pyrrolyl)dimethylsilanol, 97% | 1-Boc-2-(hydroxydimethylsilyl)pyrrol

Storage

Store at 2-8°C

Shipped In

Wet ice

Descripción general

Description

(N-Boc-2-pyrrolyl)dimethylsilanol can be used as a substrate:To prepare cross-coupling products by reacting with various aryl iodides.In the synthesis of alkoxyhydrosiloxanes by reacting with alkoxyhydrosilanes.

Specifications

Sinónimos

tert-butyl 2-[hydroxy(dimethyl)silyl]pyrrole-1-carboxylate | SCHEMBL2176723 | TERT-BUTYL 2-(HYDROXYDIMETHYLSILYL)PYRROLE-1-CARBOXYLATE | N-Boc-2-Hydroxydimethylsilanyl-pyrrole | (N-Boc-2-pyrrolyl)dimethylsilanol, 97% | 1-Boc-2-(hydroxydimethylsilyl)pyrrol

Especificaciones y pureza

≥97%

Condiciones de almacenamiento de almacenamiento

Store at 2-8°C

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

• Sonrisas canónicas: CC(C)(C)OC(=O)N1C=CC=C1[Si](C)(C)O
• IUPAC Name: tert-butyl 2-[hydroxy(dimethyl)silyl]pyrrole-1-carboxylate
• InChIKey: RLDVDBYGGISJNL-UHFFFAOYSA-N
• INCHI: 1S/C11H19NO3Si/c1-11(2,3)15-10(13)12-8-6-7-9(12)16(4,5)14/h6-8,14H,1-5H3
• Isómeros SMILES: CC(C)(C)OC(=O)N1C=CC=C1[Si](C)(C)O
• Peso molecular: 241.36
• Reaxy-Rn: 10252691
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=10252691&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • Clase Pyrroles
      • Subclass Pyrrole carboxylic acids and derivatives

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Clase: Pyrroles
• Subclass: Pyrrole carboxylic acids and derivatives
• Intermediate Tree Nodes: Not available
• Direct Parent: Pyrrole carboxylic acids and derivatives
• Alternative Parents: Alkylarylsilanes Substituted pyrroles Heteroaromatic compounds Silanols Organoheterosilanes Organic metalloid salts Azacyclic compounds Organooxygen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives
• Molecular Framework: Aromatic heteromonocyclic compounds
• Substituents: Pyrrole-1-carboxylic acid or derivatives - Alkylarylsilane - Substituted pyrrole - Heteroaromatic compound - Organoheterosilane - Silanol - Organic metalloid salt - Azacycle - Organic metalloid moeity - Organosilicon compound - Organic oxygen compound - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Organic oxide - Hydrocarbon derivative - Aromatic heteromonocyclic compound
• Descripción: This compound belongs to the class of organic compounds known as pyrrole carboxylic acids and derivatives. These are heterocyclic compounds containing a pyrrole ring bearing a carboxyl group (or a derivative thereof).
• 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

• Punto de inflamación (°F): Not applicable
• Punto de inflamación (°C): Not applicable
• Punto de fusión (°C): 48-57℃
• Peso molecular: 241.360 g/mol
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 3
• Exact Mass: 241.113 Da
• Monoisotopic Mass: 241.113 Da
• Topological Polar Surface Area: 51.500 Ų
• Heavy Atom Count: 16
• Formal Charge: 0
• Complexity: 273.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• 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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