Overview & Chemical Identity
CAS Number: 890038-13-8
Chemical Name: 4-(Hydroxymethyl)-3-methoxybenzonitrile
IUPAC Name: 4-(Hydroxymethyl)-3-methoxybenzonitrile
Synonyms:
3-Methoxy-4-(hydroxymethyl)benzonitrile;
4-Cyanomethyl-2-methoxybenzyl alcohol;
(4-Cyano-2-methoxyphenyl)methanol
Molecular Formula: C₉H₉NO₂
Molecular Weight: ~163.17 g/mol
Physical & Chemical Properties
Appearance: Off-white to light beige crystalline powder
Physical State: Solid
Melting Point: Typically reported in the range of 90–105 °C (may vary depending on purity)
Boiling Point: Not typically reported; may decompose at elevated temperatures
Solubility:
Soluble in common organic solvents such as methanol, ethanol, ethyl acetate, acetone, and DMSO; limited solubility in water
Stability:
Stable under standard laboratory conditions; may be sensitive to strong oxidizing agents and prolonged exposure to moisture
Structural & Molecular Identifiers
Functional Groups:
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Nitrile group (–C≡N)
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Primary alcohol group (–CH₂OH)
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Methoxy group (–OCH₃)
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Aromatic benzene ring
Chemical Class:
Substituted benzonitrile / Aromatic nitrile compound
SMILES (representative):
COC1=CC(=CC=C1C#N)CO
InChI Key (representative):
(Varies by database; available from chemical registries)
Functionality & Applications
Pharmaceutical & Fine Chemical Intermediate
890038-13-8 is commonly used as a synthetic intermediate in the preparation of:
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Active pharmaceutical ingredients (APIs)
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Biologically active heterocyclic compounds
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Specialty chemical derivatives
The presence of nitrile, hydroxymethyl, and methoxy groups enables versatile chemical transformations.
Organic Synthesis Applications
This compound serves as a valuable building block in:
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Functional group interconversions
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Oxidation and reduction reactions
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Cyclization reactions
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Nitrile-to-amide or acid conversions
The hydroxymethyl group allows further derivatization, while the nitrile group provides a handle for multi-step synthesis strategies.
Research & Development
Frequently utilized in:
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Medicinal chemistry programs
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Structure–activity relationship (SAR) studies
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Development of novel synthetic routes
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Academic and industrial R&D laboratories
Its multifunctional aromatic structure supports complex molecule construction.
Safety & Handling
GHS Classification (typical for similar compounds):
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Harmful if swallowed
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Causes skin and eye irritation
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May cause respiratory irritation
Common Hazard Statements:
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H302: Harmful if swallowed
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H315: Causes skin irritation
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H319: Causes serious eye irritation
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H335: May cause respiratory irritation
Precautionary Statements:
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P261: Avoid breathing dust
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P280: Wear protective gloves and eye protection
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P305 + P351 + P338: IF IN EYES, rinse cautiously with water and remove contact lenses
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P301 + P312: IF SWALLOWED, call a doctor if you feel unwell
Handle in a well-ventilated area using appropriate personal protective equipment (PPE).
Practical Details & Supplier Information
Typical Purity: 97–99% (Research and Industrial Grade)
Storage Conditions:
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Store in a tightly sealed container
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Keep in a cool, dry, and well-ventilated area
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Protect from moisture and direct sunlight
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Keep away from strong oxidizing agents
Commercial Use:
Supplied by specialty chemical manufacturers for research and industrial organic synthesis applications.
Not intended for direct pharmaceutical, food, or diagnostic use without appropriate regulatory compliance.
Summary Statement
890038-13-8 (4-(Hydroxymethyl)-3-methoxybenzonitrile) is a multifunctional aromatic nitrile widely used as an intermediate in pharmaceutical and fine chemical synthesis. Its combination of nitrile, hydroxymethyl, and methoxy functional groups makes it a versatile building block for complex organic transformations and advanced research applications.
As a trusted manufacturer and supplier in Hyderabad, SriniChem provides high-quality 890038-13-8 (4-(Hydroxymethyl)-3-methoxybenzonitrile) produced under strict quality control standards. Our product, with CAS No: 890038-13-8, is suitable for both research and industrial use. Choose SriniChem for reliable supply, technical expertise, and customer-focused service. Contact SriniChem today for 4-(Hydroxymethyl)-3-methoxybenzonitrile.
