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2-(2,3,6-trimethylphenoxy)acetic Acid structure
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2-(2,3,6-trimethylphenoxy)acetic Acid

TL;DR: 2-(2,3,6-trimethylphenoxy)acetic Acid (CAS 104295-97-8) is a chemical compound with molecular formula C11H14O3 and molecular weight 194.0943 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

2-(2,3,6-trimethylphenoxy)acetic acid

Also Known As: 2-(2,3,6-trimethylphenoxy)acetic Acid, (2,3,6-TRIMETHYLPHENOXY)ACETIC ACID, 2-(2,3,6-trimethylphenoxy)aceticacid, CHEMBRDG-BB 6878260, 2,3,6-TRIMETHYLPHENOXYACETIC ACID

CAS Number
104295-97-8
Molecular Formula
C11H14O3
Molecular Weight
194.0943 g/mol
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Technical Specifications

Molecular FormulaC11H14O3
Molecular Weight194.0943 g/mol
XLogP2.6
Topological Polar Surface Area (TPSA)46.5 Ų
Hydrogen Bond Donors1
Hydrogen Bond Acceptors3
Rotatable Bonds3
Exact Mass194.0943 Da
Heavy Atoms14
Complexity203.0
SMILESCC1=C(C(=C(C=C1)C)OCC(=O)O)C
InChIKeyYINBWASSUBWPJJ-UHFFFAOYSA-N

Chemical Property Profile of 2-(2,3,6-trimethylphenoxy)acetic Acid

XLogP
2.6
TPSA (Topological Polar Surface Area)
46.5
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
3
Rotatable Bonds
3
Heavy Atoms
14
Complexity
203.0
Exact Mass
194.0943
Monoisotopic Mass
194.0943
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-(2,3,6-trimethylphenoxy)acetic Acid

The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(2,3,6-trimethylphenoxy)acetic Acid. With a topological polar surface area (TPSA) of 46.5 Ų, 2-(2,3,6-trimethylphenoxy)acetic Acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(2,3,6-trimethylphenoxy)acetic Acid has 1 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-(2,3,6-trimethylphenoxy)acetic Acid?

The CAS number of 2-(2,3,6-trimethylphenoxy)acetic Acid is 104295-97-8.

What is the molecular formula of 2-(2,3,6-trimethylphenoxy)acetic Acid?

The molecular formula of 2-(2,3,6-trimethylphenoxy)acetic Acid is C11H14O3.

What is the molecular weight of 2-(2,3,6-trimethylphenoxy)acetic Acid?

The molecular weight of 2-(2,3,6-trimethylphenoxy)acetic Acid is 194.0943 g/mol.

Where can I buy 2-(2,3,6-trimethylphenoxy)acetic Acid?

You can request a quote for 2-(2,3,6-trimethylphenoxy)acetic Acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for 2-(2,3,6-trimethylphenoxy)acetic Acid?

Yes, CoreyChem provides custom synthesis services for 2-(2,3,6-trimethylphenoxy)acetic Acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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