3,5-Dimethyl-4-nitrophenol

Name: 3,5-Dimethyl-4-nitrophenol
Brand: ChemScene
Availability: InStock
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CAS No. 5344-97-8
Cat. No. CS-0061140
Purity≥98%
MDL No.None

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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 5344-97-8

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Description

3,5-Dimethyl-4-nitrophenol features a nitro-substituted aromatic ring flanked by two methyl groups, delivering enhanced electron deficiency at the para-position. This configuration supports stable participation in electrophilic coupling reactions and facilitates selective functionalization under mild conditions. The compound exhibits improved solubility in organic solvents compared to unsubstituted analogs, enabling straightforward integration into synthetic workflows.

Application

3,5-Dimethyl-4-nitrophenol serves as a valuable building block in synthetic organic chemistry, enabling the construction of substituted aromatic systems through established coupling and reduction protocols. Its nitro group facilitates electrophilic substitution and subsequent functionalization, while the methyl groups provide steric and electronic modulation. The compound exhibits bench stability and ease of purification, making it well-suited for use in medicinal chemistry campaigns and heterocyclic scaffold development.

General Information

CAS No. 5344-97-8
Cat. No. CS-0061140
Purity ≥98%
MDL No. None
Storage RT, stored under nitrogen
Shipping Room temperature in continental US; may vary elsewhere.
Molecular Formula C₈H₉NO₃
Molecular Weight 167.16
Synonym(s) 3,5-Dimethyl-4-nitropheno
SMILES CC1=C(C(=CC(=C1)O)C)[N+](=O)[O-]

Computational Chemistry Data

TPSA 63.37
LogP 1.91724
H_Acceptors 3
H_Donors 1
Rotatable_Bonds 1

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 Nitro compounds

Building Blocks Skeleton Aromatic ring compounds Benzene compounds

Key Words

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3,5-Dimethyl-4-nitrophenol

CAS No. 5344-97-8

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