Methyl 4-chlorophenylacetate

Name: Methyl 4-chlorophenylacetate
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CAS No. 52449-43-1
Cat. No. CS-W022850
Purity≥98%
MDL No.MFCD00032743

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Structure of 52449-43-1

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General Information

CAS No. 52449-43-1
Cat. No. CS-W022850
Purity ≥98%
MDL No. MFCD00032743
Storage Store at room temperature
Shipping Room temperature in continental US; may vary elsewhere.
Molecular Formula C₉H₉ClO₂
Molecular Weight 184.62
Synonym(s) Methyl p-chlorophenylacetate
SMILES O=C(OC)CC1=CC=C(Cl)C=C1

Description

Methyl 4-chlorophenylacetate is a bench-stable ester featuring a para-chlorinated phenyl ring linked to a methylene-acetate chain. This configuration delivers enhanced solubility in organic solvents and stability under standard conditions, enabling efficient integration into synthetic sequences involving nucleophilic substitution or catalytic coupling reactions.

Application

Methyl 4-chlorophenylacetate serves as a versatile building block in synthetic organic chemistry, enabling efficient access to pharmaceutically relevant arylacetic acid derivatives. Its stability under standard reaction conditions and compatibility with diverse coupling and functionalization protocols facilitate straightforward incorporation into complex molecular architectures. The ortho-chlorinated phenyl moiety provides a handle for further derivatization, while the ester group allows selective reduction or hydrolysis to yield key intermediates in active pharmaceutical ingredient synthesis.

Safety Information

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GHS Pictogram :	GHS No : GHS07,GHS09
Signal Word : Warning	UN#: N/A
Class : N/A	Packing Group : N/A
Hazard Statements : H302-H411
Precautionary Statements : P264-P270-P273-P391-P501

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Computational Chemistry Data

TPSA 26.3
LogP 2.0555
H_Acceptors 2
H_Donors 0
Rotatable_Bonds 2

Other Classifications

Building Blocks Functional Group Ester

Building Blocks Skeleton Aromatic ring compounds Benzene compounds

Key Words

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Methyl 4-chlorophenylacetate

CAS No. 52449-43-1

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