Pentylmagnesium bromide solution - 2.0M in diethyl ether , CAS No.693-25-4

CAS: 693-25-4 Cat. No.: P466408 분자식: C₅H₁₁BrMg 분자량: 175.35 EC 번호: 211-747-9 PubChem CID: 101838

GRADE & PURITY 2.0M in diethyl ether

Synonyms

amyl magnesium bromide | Amylmagnesium bromide | amyl-magnesium bromide | n-Pentyl magnesium bromide | ZXWGTPYWPZGZPT-UHFFFAOYSA-M | AKOS015902926 | Bromopentylmagnesium | pentylmagnesiumbromide | DTXSID20883478 | Pentylmagnesium bromide, 1.0 M in THF | P

Storage

Store at 2-8°C,Argon charged

Shipped In

Wet ice

개요

Description

Pentylmagnesium bromide solution is a Grignard reagent that can be used in the preparation of:Alkanes via Ni or Cu-catalyzed cross-coupling reaction with alkyl fluorides.Hydroxypiperidinones via the addition-cyclization-deprotection process of aldimines.It can also be used as a reagent to synthesize a key intermediate by olefin alkylation in the total synthesis of alkaloid, (+)-hyperaspine , and surface alkylation of H-terminated Si (111), by Si-C bond formation.

Specifications

동의어

amyl magnesium bromide | Amylmagnesium bromide | amyl-magnesium bromide | n-Pentyl magnesium bromide | ZXWGTPYWPZGZPT-UHFFFAOYSA-M | AKOS015902926 | Bromopentylmagnesium | pentylmagnesiumbromide | DTXSID20883478 | Pentylmagnesium bromide, 1.0 M in THF | P

사양 및 순도

2.0M in diethyl ether

보관 조건

Store at 2-8°C,Argon charged

배송

Wet ice

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이름과 식별자

Pubchem Sid

508813546

정식 스마일

CCCC[CH2-].[Mg+2].[Br-]

IUPAC Name

magnesium;pentane;bromide

InChIKey

XWCQLLDGXBLGMD-UHFFFAOYSA-M

INCHI

1S/C5H11.BrH.Mg/c1-3-5-4-2;;/h1,3-5H2,2H3;1H;/q-1;;+2/p-1

이성체 SMILES

CCCC[CH2-].[Mg+2].[Br-]

WGK 독일

1

PubChem CID

101838

분자량

175.35

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic salts
    • 분류 Organic metal salts
      • Subclass Organic metal halides

• Kingdom: Organic compounds
• Superclass: Organic salts
• 분류: Organic metal salts
• Subclass: Organic metal halides
• Intermediate Tree Nodes: Not available
• Direct Parent: Organic metal halides
• Alternative Parents: Organic metal bromide salts Organic bromide salts Hydrocarbon derivatives
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Organic metal halide - Organic metal bromide salt - Hydrocarbon derivative - Organic bromide salt - Aliphatic acyclic compound
• 설명: This compound belongs to the class of organic compounds known as organic metal halides. These are organic compounds containing metals and halogens. Some are ionic while others are covalently bonded.
• 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

화학 및 물리적 특성

• 감도: Air & Moisture sensitive
• 발화점(°F): -40 °C
• 발화점(°C): -40°C
• 분자량: 175.350 g/mol
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 173.989 Da
• Monoisotopic Mass: 173.989 Da
• Topological Polar Surface Area: 0.000 Ų
• Heavy Atom Count: 7
• Formal Charge: 0
• Complexity: 17.600
• 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: 3

XLogP3