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(1,3-Dioxolan-2-ylmethyl)magnesium bromide solution - 0.5M in THF, high purity , CAS No.180675-22-3

    Grade & Purity:
  • 0.5M in THF
In stock
Item Number
D465905
Grouped product items
SKU Size
Availability
Price Qty
D465905-100ml
100ml
1
$374.90
View related series
Grignard reagent (95)

Basic Description

Synonyms AKOS015909032 | 4-HYDROXY-3-METHYLBENZYLALCOHOL | SCHEMBL285800 | (1,3-dioxolan-2-ylmethyl)magnesium bromide | 1,3-Dioxolan-2-ylmethylmagnesium bromide, 0.50 M in 2-MeTHF | 1,3-Dioxolan-2-ylmethylmagnesium bromide | ZDNTZRAFJZERSL-UHFFFAOYSA-M | 2-[(bromo
Specifications & Purity 0.5M in THF
Storage Temp Argon charged
Shipped In Normal
Product Description

Description

(1,3-Dioxolan-2-ylmethyl)magnesium bromide is a Grignard reagent that can be used to prepare:3-[11C]-Propionaldehyde, a key intermediate for the synthesis of radiolabeled compound [11C]SN-38, wherein SN-38 is 7-ethyl-10-hydroxy camptothecin.1-[(S)-2,2-Dimethyl-(1,3)-dioxolan-4-yl]-4-(1,3-dioxolan2-yl)-2-ol by reacting with D-glyceraldehyde, which is further used to synthesize unsaturated nucleosides.A bicyclo carboxylate intermediate, which is employed in the total synthesis of spirovibsanin A.

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
Superclass Organoheterocyclic compounds
Class Dioxolanes
Subclass 1,3-dioxolanes
Intermediate Tree Nodes Not available
Direct Parent 1,3-dioxolanes
Alternative Parents Oxacyclic compounds  Organic metal halides  Organic metal bromide salts  Acetals  Organic bromide salts  Hydrocarbon derivatives  Organic cations  
Molecular Framework Aliphatic heteromonocyclic compounds
Substituents Meta-dioxolane - Organic metal halide - Oxacycle - Organic metal bromide salt - Acetal - Organic oxygen compound - Hydrocarbon derivative - Organic bromide salt - Organic salt - Organooxygen compound - Organic cation - Aliphatic heteromonocyclic compound
Description This compound belongs to the class of organic compounds known as 1,3-dioxolanes. These are organic compounds containing 1,3-dioxolane, an aliphatic five-member ring with two oxygen atoms in ring positions 1 and 3.
External Descriptors Not available

Names and Identifiers

IUPAC Name magnesium;2-methanidyl-1,3-dioxolane;bromide
INCHI InChI=1S/C4H7O2.BrH.Mg/c1-4-5-2-3-6-4;;/h4H,1-3H2;1H;/q-1;;+2/p-1
InChIKey IERSPCAGKAOLSQ-UHFFFAOYSA-M
Smiles [CH2-]C1OCCO1.[Mg+2].[Br-]
Isomeric SMILES [CH2-]C1OCCO1.[Mg+2].[Br-]
WGK Germany 3
Molecular Weight 191.31
Reaxy-Rn 5491248
Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=5491248&ln=

Certificates(CoA,COO,BSE/TSE and Analysis Chart)

C of A & Other Certificates(BSE/TSE, COO):
Analytical Chart:

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Lot Number Certificate Type Date Item
J2330430 Certificate of Analysis Sep 08, 2023 D465905

Chemical and Physical Properties

Sensitivity air sensitive
Flash Point(°F) 1.4 °F
Flash Point(°C) -17 °C
Boil Point(°C) 65-67 °C
Molecular Weight 191.310 g/mol
XLogP3
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 0
Exact Mass 189.948 Da
Monoisotopic Mass 189.948 Da
Topological Polar Surface Area 18.500 Ų
Heavy Atom Count 8
Formal Charge 0
Complexity 47.300
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

Solution Calculators

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