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2,4,5-T-isopropyl structure
Fine Chemical

2,4,5-T-isopropyl

TL;DR: 2,4,5-T-isopropyl (CAS 93-78-7) is a chemical compound with molecular formula C11H11Cl3O3 and molecular weight 295.9774 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

propan-2-yl 2-(2,4,5-trichlorophenoxy)acetate

Also Known As: 2,4,5-T isopropyl ester, 2,4,5-T-isopropyl, Caswell No. 881T, 2,4,5-T-isopropyl [ISO], 2.4.5-T Isopropyl Ester

CAS Number
93-78-7
Molecular Formula
C11H11Cl3O3
Molecular Weight
295.9774 g/mol
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Technical Specifications

Molecular FormulaC11H11Cl3O3
Molecular Weight295.9774 g/mol
XLogP4.4
Topological Polar Surface Area (TPSA)35.5 Ų
Hydrogen Bond Donors0
Hydrogen Bond Acceptors3
Rotatable Bonds5
Exact Mass295.9774 Da
Heavy Atoms17
Complexity260.0
SMILESCC(C)OC(=O)COC1=CC(=C(C=C1Cl)Cl)Cl
InChIKeySXHQLHGHMREHMX-UHFFFAOYSA-N

Product Description

Applications: 2,4,5-T-isopropyl is used in organic synthesis and process chemistry. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full analytical documentation (COA, MSDS, HPLC, NMR, MS).

2,4,5-T-isopropyl (CAS 93-78-7) is a fine chemical with the molecular formula C11H11Cl3O3 and a molecular weight of 295.98 g/mol. Synonyms include 2,4,5-T isopropyl ester and 2,4,5-T-isopropyl.

Custom synthesis and full analytical documentation (COA/MSDS) are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.

Chemical Property Profile of 2,4,5-T-isopropyl

XLogP
4.4
TPSA (Topological Polar Surface Area)
35.5
Hydrogen Bond Donors
0
Hydrogen Bond Acceptors
3
Rotatable Bonds
5
Heavy Atoms
17
Complexity
260.0
Exact Mass
295.9774
Monoisotopic Mass
295.9774
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 2,4,5-T-isopropyl

The XLogP value of 4.4 indicates that 2,4,5-T-isopropyl is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 35.5 Ų, 2,4,5-T-isopropyl exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,4,5-T-isopropyl has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of 2,4,5-T-isopropyl?

The CAS number of 2,4,5-T-isopropyl is 93-78-7.

What is the molecular formula of 2,4,5-T-isopropyl?

The molecular formula of 2,4,5-T-isopropyl is C11H11Cl3O3.

What is the molecular weight of 2,4,5-T-isopropyl?

The molecular weight of 2,4,5-T-isopropyl is 295.9774 g/mol.

What are the applications of 2,4,5-T-isopropyl?

2,4,5-T-isopropyl is used in organic synthesis and process chemistry. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full analytical documentation (COA, MSDS, HPLC, NMR, MS).

Where can I buy 2,4,5-T-isopropyl?

You can request a quote for 2,4,5-T-isopropyl directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for 2,4,5-T-isopropyl?

Yes, CoreyChem provides custom synthesis services for 2,4,5-T-isopropyl and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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