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2,6-DI-Tert-butyl-4-methylphenyldiazo acetate structure
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2,6-DI-Tert-butyl-4-methylphenyldiazo acetate

TL;DR: 2,6-DI-Tert-butyl-4-methylphenyldiazo acetate (CAS 125640-92-8) is a chemical compound with molecular formula C17H24N2O2 and molecular weight 288.18378 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

(2,6-ditert-butyl-4-methylphenyl) 2-diazoacetate

Also Known As: 2,6-DI-TERT-BUTYL-4-METHYLPHENYLDIAZO ACETATE, (2,6-ditert-butyl-4-methylphenyl) 2-diazoacetate, 2,6-Di-tert.-butyl-4-methylphenyldiazo acetate, 2,6-di-t-butyl-4-methyl-phenyl diazoacetate, J1.301.577E

CAS Number
125640-92-8
Molecular Formula
C17H24N2O2
Molecular Weight
288.18378 g/mol
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Technical Specifications

Molecular FormulaC17H24N2O2
Molecular Weight288.18378 g/mol
XLogP5.6
Topological Polar Surface Area (TPSA)28.3 Ų
Hydrogen Bond Donors0
Hydrogen Bond Acceptors3
Rotatable Bonds5
Exact Mass288.18378 Da
Heavy Atoms21
Complexity401.0
SMILESCC1=CC(=C(C(=C1)C(C)(C)C)OC(=O)C=[N+]=[N-])C(C)(C)C
InChIKeyJWOHWTRHFIOQSH-UHFFFAOYSA-N

Chemical Property Profile of 2,6-DI-Tert-butyl-4-methylphenyldiazo acetate

XLogP
5.6
TPSA (Topological Polar Surface Area)
28.3
Hydrogen Bond Donors
0
Hydrogen Bond Acceptors
3
Rotatable Bonds
5
Heavy Atoms
21
Complexity
401.0
Exact Mass
288.18378
Monoisotopic Mass
288.18378
Data Source: Chemical property values are referenced from PubChem, the world's largest open chemistry database maintained by the National Center for Biotechnology Information (NCBI), U.S. National Library of Medicine.

Property Insights of 2,6-DI-Tert-butyl-4-methylphenyldiazo acetate

The XLogP value of 5.6 indicates that 2,6-DI-Tert-butyl-4-methylphenyldiazo acetate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 28.3 Ų, 2,6-DI-Tert-butyl-4-methylphenyldiazo acetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,6-DI-Tert-butyl-4-methylphenyldiazo acetate has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.

Frequently Asked Questions

What is the CAS number of 2,6-DI-Tert-butyl-4-methylphenyldiazo acetate?

The CAS number of 2,6-DI-Tert-butyl-4-methylphenyldiazo acetate is 125640-92-8.

What is the molecular formula of 2,6-DI-Tert-butyl-4-methylphenyldiazo acetate?

The molecular formula of 2,6-DI-Tert-butyl-4-methylphenyldiazo acetate is C17H24N2O2.

What is the molecular weight of 2,6-DI-Tert-butyl-4-methylphenyldiazo acetate?

The molecular weight of 2,6-DI-Tert-butyl-4-methylphenyldiazo acetate is 288.18378 g/mol.

Where can I buy 2,6-DI-Tert-butyl-4-methylphenyldiazo acetate?

You can request a quote for 2,6-DI-Tert-butyl-4-methylphenyldiazo acetate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for 2,6-DI-Tert-butyl-4-methylphenyldiazo acetate?

Yes, CoreyChem provides custom synthesis services for 2,6-DI-Tert-butyl-4-methylphenyldiazo acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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