3-Fluoro-4-methylphenol

Name: 3-Fluoro-4-methylphenol
Brand: ChemScene
Availability: InStock
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CAS No. 452-78-8
Cat. No. CS-W016564
Purity≥96%
MDL No.MFCD00143164

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Type	HazMat Fee
Excepted Quantity	$0.00
FedEx Limited Quantities Ground	$0.00
Hazmat Ground shipping	$50.00+
Inaccessible (Haz class 6.1 or 9), Domestic	$68.00+
Accessible (Haz class 3, 4, 5 or 8), Domestic	$158.00+
Inaccessible (Haz class 6.1 or 9), International	$108.00+
Accessible (Haz class 3, 4, 5 or 8), International	$238.00+

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Structure of 452-78-8

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Description

3-Fluoro-4-methylphenol features a fluorine atom ortho to a phenolic hydroxyl group and a methyl substituent at the para position, creating a uniquely activated aromatic system. This combination enhances electrophilic substitution reactivity while maintaining stability under standard bench conditions. The molecule integrates readily into complex synthetic scaffolds requiring directed functionalization or serves as a building block in agrochemical and pharmaceutical development.

Application

3-Fluoro-4-methylphenol serves as a versatile building block in medicinal chemistry and agrochemical synthesis, enabling direct functionalization at the aromatic ring due to its orthogonal reactivity profile. The fluorine and methyl groups provide favorable electronic and steric modulation, enhancing metabolic stability and binding affinity in target molecules. Its bench-stable nature and compatibility with standard coupling reactions facilitate efficient incorporation into complex scaffolds.

General Information

CAS No. 452-78-8
Cat. No. CS-W016564
Purity ≥96%
MDL No. MFCD00143164
Storage -20°C
Shipping Room temperature in continental US; may vary elsewhere.
Molecular Formula C₇H₇FO
Molecular Weight 126.13
Synonym(s) Phenol, 3-fluoro-4-methyl; 3-Fluoro-4-methylphenol
SMILES FC1=C(C=CC(=C1)O)C

Computational Chemistry Data

TPSA 20.23
LogP 1.83972
H_Acceptors 1
H_Donors 1
Rotatable_Bonds 0

Safety Information

Download SDS

GHS Pictogram :	GHS No : GHS07
Signal Word : Warning	UN#: N/A
Class : N/A	Packing Group : N/A
Hazard Statements : H302-H315-H319-H335
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501

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Other Classifications

Building Blocks Functional Group Fluoride

Building Blocks Skeleton Aromatic ring compounds Benzene compounds

Key Words

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3-Fluoro-4-methylphenol

CAS No. 452-78-8

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