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3,5-Dimethyl-4-hydroxybenzonitrile

CAS 4198-90-7 · Alcohol / Hydroxyl Compound · 3 functional traits · cGMP compliant · Ships from USA in 2-3 days

Alcohol / Hydroxyl Compound

3,5-Dimethyl-4-hydroxybenzonitrile

Alcohols PharmaceuticalFine ChemicalResearchFormulationAgrochemicalMedicinal Chemistry
CAS Number 4198-90-7
Category Alcohol / Hydroxyl Compound · Nitrile
Origin USA
Compliance cGMP

Questions? Contact our chemistry team:

chemistry@chem-contract.com | +1 (714) 732-8549
In stock — typically ships within 2-3 business days

About 3,5-Dimethyl-4-hydroxybenzonitrile

3,5-Dimethyl-4-hydroxybenzonitrile (CAS Number: 4198-90-7) is a hydroxyl-bearing compound with hydrogen-bonding capability with defined stereochemistry. ChemContract Research supplies this moderate-complexity compound in high purity from our Huntington Beach, California facility, ensuring consistent quality and reliable domestic delivery throughout the United States.

Hydroxyl groups are critical pharmacophores — they serve as hydrogen-bond donors and acceptors, influencing drug–target binding, aqueous solubility, and metabolic susceptibility. The nitrile group is a bioisostere for both carboxylic acids and amides, and has emerged as a covalent warhead in next-generation kinase inhibitors like saxagliptin and neratinib. Chirality matters profoundly in drug action — enantiomers can differ by orders of magnitude in potency, and FDA guidelines increasingly require single-enantiomer development.

Primary applications include mitsunobu reaction substrate for stereospecific inversion at chiral centers and hydrolysis to carboxylic acids or amides under controlled conditions. This compound serves researchers and manufacturers across the pharmaceutical, fine chemical, research sectors. Whether you require 3,5-Dimethyl-4-hydroxybenzonitrile for early-stage research, process development, or commercial-scale production, ChemContract Research offers flexible ordering from milligram to multi-kilogram quantities with custom synthesis options and full batch documentation including Certificates of Analysis (CoA) and Safety Data Sheets.

Functional Groups: Nitrile (–C≡N)Hydroxyl (–OH)
Stereochemistry: Defined Configuration

Alcohol / Hydroxyl Compound Applications & Target Industries

How 3,5-Dimethyl-4-hydroxybenzonitrile is used across pharmaceutical and fine chemical sectors

01

Mitsunobu reaction substrate for stereospecific inversion at chiral centers

02

Hydrolysis to carboxylic acids or amides under controlled conditions

03

Enantiopure building block for single-enantiomer drug development

04

Oxidation to aldehydes (Swern, Dess–Martin) or ketones for downstream chemistry

05

Click chemistry precursor for tetrazole formation (azide–nitrile cycloaddition)

06

Chiral resolution standard or chiral HPLC reference compound

Target Industries: PharmaceuticalFine ChemicalResearchFormulationAgrochemicalMedicinal Chemistry

3,5-Dimethyl-4-hydroxybenzonitrile Specifications

Detailed specifications for this alcohol / hydroxyl compound, including purity, molecular weight, and analytical data are available upon request. Every batch from ChemContract Research includes:

  • Certificate of Analysis (CoA) with purity verification
  • HPLC, NMR, and/or mass spectrometry characterization data
  • Material Safety Data Sheet (MSDS/SDS)
  • Batch-specific documentation and lot traceability
  • Custom analytical testing available on request
Request Full Specifications

Quick Reference

Compound Name 3,5-Dimethyl-4-hydroxybenzonitrile
Type Alcohol / Hydroxyl Compound
Category Alcohol / Hydroxyl Compound · Nitrile
Purity ≥95% (custom grades available)
Stereochemistry Defined configuration (chiral HPLC verified)
Complexity Moderate (2 functional groups, 0 rings)
Compliance cGMP
Packaging mg to kg scale

Storage & Handling for Alcohol / Hydroxyl Compounds

Handling Guidelines

Handle with standard precautions. Some alcohols are flammable. Use adequate ventilation and appropriate PPE. Some nitriles may release HCN upon decomposition. Handle in a well-ventilated fume hood with a cyanide antidote kit accessible. Handle with standard precautions. Ensure proper labeling of stereochemical identity to prevent mix-ups.

Storage Conditions

Store at room temperature in a tightly sealed container away from heat sources and oxidizers. Store in a cool, dry, well-ventilated area. Keep tightly sealed and away from acids and strong bases. Store under recommended conditions. Some chiral compounds may racemize at elevated temperatures or in the presence of base.

Why Buy 3,5-Dimethyl-4-hydroxybenzonitrile From ChemContract?

Quality Assured

Every batch of 3,5-Dimethyl-4-hydroxybenzonitrile is produced under cGMP conditions with full CoA documentation, HPLC purity verification, and lot traceability.

Fast USA Shipping

Ship from our Huntington Beach, CA facility with 2-3 business day domestic delivery. No import delays, no customs fees, no tariff surprises.

Custom Synthesis

Need a specific grade, quantity, or derivative of 3,5-Dimethyl-4-hydroxybenzonitrile? Our team of PhD chemists can develop custom synthesis solutions for your exact requirements.

Frequently Asked

Common questions about 3,5-Dimethyl-4-hydroxybenzonitrile

What is 3,5-Dimethyl-4-hydroxybenzonitrile used for? +

3,5-Dimethyl-4-hydroxybenzonitrile is a hydroxyl-bearing compound with hydrogen-bonding capability used primarily in the pharmaceutical and fine chemical industries. Key applications include mitsunobu reaction substrate for stereospecific inversion at chiral centers and hydrolysis to carboxylic acids or amides under controlled conditions.

Where can I buy 3,5-Dimethyl-4-hydroxybenzonitrile in the USA? +

ChemContract Research is a trusted USA-based supplier of 3,5-Dimethyl-4-hydroxybenzonitrile. We offer competitive pricing, fast domestic shipping from our Huntington Beach, California facility, and full quality documentation including Certificates of Analysis (CoA). Request a quote at chemistry@chem-contract.com or call +1 (714) 732-8549.

What purity levels are available for 3,5-Dimethyl-4-hydroxybenzonitrile? +

ChemContract Research supplies 3,5-Dimethyl-4-hydroxybenzonitrile in multiple purity grades: ≥95% standard grade, ≥97% high-purity grade, and ≥99% ultra-high-purity grade depending on application requirements. We can also provide custom purity grades through our synthesis capabilities. Contact us for specific purity information and CoA documentation.

Can ChemContract synthesize 3,5-Dimethyl-4-hydroxybenzonitrile in custom quantities? +

Yes. ChemContract Research offers custom synthesis services for 3,5-Dimethyl-4-hydroxybenzonitrile from milligram to multi-kilogram scale. Our cGMP-compliant facilities and experienced chemists can accommodate custom specifications, packaging requirements, and delivery timelines. Contact our team to discuss your project.

What is the stereochemical purity of 3,5-Dimethyl-4-hydroxybenzonitrile? +

ChemContract Research supplies 3,5-Dimethyl-4-hydroxybenzonitrile with verified enantiomeric or diastereomeric purity as documented in our Certificate of Analysis (CoA). Chiral HPLC analysis is standard for stereodefined compounds. We can provide material with ≥98% ee/de for demanding applications. Contact us for specific optical purity requirements.

Can the nitrile group in 3,5-Dimethyl-4-hydroxybenzonitrile be converted to other functional groups? +

Yes. The nitrile (–C≡N) in 3,5-Dimethyl-4-hydroxybenzonitrile can be hydrolyzed to a carboxylic acid (strong acid/base, heat) or to an amide (milder conditions, e.g., H₂O₂/base). It can be reduced to a primary amine (LiAlH₄ or catalytic hydrogenation), converted to a tetrazole via [3+2] cycloaddition with NaN₃, or used in Grignard additions to form ketones after hydrolysis.

How should I store 3,5-Dimethyl-4-hydroxybenzonitrile? +

Store at room temperature in a tightly sealed container away from heat sources and oxidizers. Store in a cool, dry, well-ventilated area. Keep tightly sealed and away from acids and strong bases. Store under recommended conditions. Some chiral compounds may racemize at elevated temperatures or in the presence of base. Always consult the compound-specific Safety Data Sheet (SDS) provided with your order for detailed storage requirements. ChemContract Research includes handling and storage documentation with every shipment.

What is the CAS number of 3,5-Dimethyl-4-hydroxybenzonitrile? +

The CAS Registry Number for 3,5-Dimethyl-4-hydroxybenzonitrile is 4198-90-7. This unique identifier is used worldwide to reference this specific compound in chemical databases, regulatory filings, and scientific literature. ChemContract Research supplies this compound with full quality documentation. Contact us at chemistry@chem-contract.com for availability and pricing.

Chemical analysis laboratory with HPLC instruments for purity and impurity testing Custom chemical synthesis reaction setup for pharmaceutical intermediate production

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