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2-{4-[(Tert-butyldimethylsilyl)oxy]phenyl}acetic acid structure
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2-{4-[(Tert-butyldimethylsilyl)oxy]phenyl}acetic acid

TL;DR: 2-{4-[(Tert-butyldimethylsilyl)oxy]phenyl}acetic acid (CAS 114774-40-2) is a chemical compound with molecular formula C14H22O3Si and molecular weight 266.13382 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

2-[4-[tert-butyl(dimethyl)silyl]oxyphenyl]acetic acid

Also Known As: 2-{4-[(tert-butyldimethylsilyl)oxy]phenyl}acetic acid, 2-(4-((tert-butyldimethylsilyl)oxy)phenyl)acetic acid, 4-(tert-Butyldimethylsiloxy)benzeneacetic acid, 4-Hydroxybenzeneacetic acid, TBDMS derivative, J1.496.225E

CAS Number
114774-40-2
Molecular Formula
C14H22O3Si
Molecular Weight
266.13382 g/mol
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Application Areas

Top 5 of 3 IPC patent classification(s) from the SureChEMBL global patent database.

Heterocyclic Building Blocks (3 patents) Organic Building Blocks (4 patents) Pharmaceutical Intermediates (9 patents)

Technical Specifications

Molecular FormulaC14H22O3Si
Molecular Weight266.13382 g/mol
XLogP3.6977
Topological Polar Surface Area (TPSA)46.5 Ų
Hydrogen Bond Donors1
Hydrogen Bond Acceptors3
Rotatable Bonds5
Exact Mass266.13382 Da
Heavy Atoms18
Complexity286.0
SMILESCC(C)(C)[Si](C)(C)OC1=CC=C(C=C1)CC(=O)O
InChIKeyHFGPEISRKIZIHV-UHFFFAOYSA-N

Chemical Property Profile of 2-{4-[(Tert-butyldimethylsilyl)oxy]phenyl}acetic acid

XLogP
3.6977
TPSA (Topological Polar Surface Area)
46.5
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
3
Rotatable Bonds
5
Heavy Atoms
18
Complexity
286.0
Exact Mass
266.13382
Monoisotopic Mass
266.13382
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-[(Tert-butyldimethylsilyl)oxy]phenyl}acetic acid

The XLogP value of 3.6977 indicates that 2-{4-[(Tert-butyldimethylsilyl)oxy]phenyl}acetic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.5 Ų, 2-{4-[(Tert-butyldimethylsilyl)oxy]phenyl}acetic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-{4-[(Tert-butyldimethylsilyl)oxy]phenyl}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-{4-[(Tert-butyldimethylsilyl)oxy]phenyl}acetic acid?

The CAS number of 2-{4-[(Tert-butyldimethylsilyl)oxy]phenyl}acetic acid is 114774-40-2.

What is the molecular formula of 2-{4-[(Tert-butyldimethylsilyl)oxy]phenyl}acetic acid?

The molecular formula of 2-{4-[(Tert-butyldimethylsilyl)oxy]phenyl}acetic acid is C14H22O3Si.

What is the molecular weight of 2-{4-[(Tert-butyldimethylsilyl)oxy]phenyl}acetic acid?

The molecular weight of 2-{4-[(Tert-butyldimethylsilyl)oxy]phenyl}acetic acid is 266.13382 g/mol.

Where can I buy 2-{4-[(Tert-butyldimethylsilyl)oxy]phenyl}acetic acid?

You can request a quote for 2-{4-[(Tert-butyldimethylsilyl)oxy]phenyl}acetic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for 2-{4-[(Tert-butyldimethylsilyl)oxy]phenyl}acetic acid?

Yes, CoreyChem provides custom synthesis services for 2-{4-[(Tert-butyldimethylsilyl)oxy]phenyl}acetic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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