Chlorozinc(1+) (tert-butoxycarbonyl)methanide

Base Information

• Chemical Name: Chlorozinc(1+) (tert-butoxycarbonyl)methanide
• CAS No.: 321745-86-2
• Molecular Formula: C6H11ClO2Zn
• Molecular Weight: 215.995
• DSSTox Substance ID: DTXSID60641397
• Mol file: 321745-86-2.mol

Synonyms:Chlorozinc(1+) (tert-butoxycarbonyl)methanide;chlorozinc(1+);1-[(2-methylpropan-2-yl)oxy]ethenolate;DTXSID60641397

Chemical Property of Chlorozinc(1+) (tert-butoxycarbonyl)methanide

Chemical Property:

• PSA: 26.30000
• LogP: 1.98270
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 213.973899
• Heavy Atom Count: 10
• Complexity: 91.2

Purity/Quality:

98% ^*data from raw suppliers

Chloro[2-(1,1-dimethylethoxy)-2-oxoethyl]zinc ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C)(C)OC(=C)[O-].Cl[Zn+]

Technology Process of Chlorozinc(1+) (tert-butoxycarbonyl)methanide

There total 1 articles about Chlorozinc(1+) (tert-butoxycarbonyl)methanide which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield:

acetic acid tert-butyl ester (540-88-5) + zinc chloride-2,2,6,6-tetramethylpiperidin-1-ide lithium chloride complex → 2-tert-butoxy-2-oxoethylzinc chloride (321745-86-2)

Guidance literature:

In tetrahydrofuran; at 20 ℃; for 1h; Inert atmosphere; Schlenk technique;

DOI:10.1002/anie.201713278

Reference yield: 99.0%

2-tert-butoxy-2-oxoethylzinc chloride (321745-86-2) + (3S,6R)-2-[(4-bromo-2,5-difluoro-phenyl)methyl]-3-methyl-6-phenyl-thiazinane 1,1-dioxide → tert-butyl 2-[2,5-difluoro-4-[[(3S,6R)-3-methyl-1,1-dioxo-6-phenyl-1-lambda6,2-thiazinan-2-yl]methyl]phenyl]acetate

Guidance literature:

With monophosphine 1,2,3,4,5-pentaphenyl-1'-(di-tert-butylphosphino)ferrocene; bis(dibenzylideneacetone)-palladium⁽⁰⁾; In tetrahydrofuran; diethyl ether; at 20 ℃; for 4h; Inert atmosphere;

Reference yield: 98.0%

4-benzyloxy-1-bromo-2-methoxybenzene (171768-67-5) + 2-tert-butoxy-2-oxoethylzinc chloride (321745-86-2) → tert-butyl [4-(benzyloxy)-2-methoxyphenyl]acetate (948571-54-8)

Guidance literature:

With tris-(dibenzylideneacetone)dipalladium⁽⁰⁾; XPhos; In tetrahydrofuran; at 60 ℃; for 0.5h; Inert atmosphere;

upstream raw materials:

acetic acid tert-butyl ester

Downstream raw materials:

C₂₀H₁₇ClF₃NO₃

C₂₁H₂₀F₃NO₄

(2-chloro-5-(5-methanesulfonyl-1-(3-morpholin-4-yl-propyl)-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridin-3-yl)-phenyl)-acetic acid tert-butyl ester

tert-butyl {2-[(1-biphenyl-4-yl-2-oxo-1,2-dihydro-1'H-spiro[indole-3,4'-piperidin]-1'-yl)methyl]pyridin-3-yl}acetate

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