Metronidazole Benzoate

Name: Metronidazole Benzoate
Brand: ChemScene
Availability: InStock
Rating: 5 (1 reviews)

CAS No. 13182-89-3
Cat. No. CS-0090787
Purity≥98%
MDL No.MFCD00693654

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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+

An item is classified as a dangerous good if our website displays Hazardous Material (HazMat) information for it.

There is a HazMat shipping fee for each item that qualifies as a dangerous good. Please contact our quotation team via email to confirm the details.

*For research and further manufacturing use only, not for direct human use.

Structure of 13182-89-3

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General Information

CAS No. 13182-89-3
Cat. No. CS-0090787
Purity ≥98%
MDL No. MFCD00693654
Storage 4°C
Shipping Room temperature in continental US; may vary elsewhere.
Molecular Formula C₁₃H₁₃N₃O₄
Molecular Weight None
Synonym(s) Benzoyl metronidazole
SMILES O=[N+](C1=CN=C(C)N1CCOC(C2=CC=CC=C2)=O)[O-]

Description

Application

Metronidazole Benzoate serves as a stable, crystalline derivative that facilitates the handling and delivery of metronidazole in synthetic workflows. It functions as a prodrug scaffold enabling controlled release of the active nitroimidazole moiety, with enhanced lipophilicity for improved membrane permeability. The benzoate ester group offers predictable hydrolysis under physiological conditions and demonstrates compatibility with standard organic transformations, including hydrogenation and nucleophilic substitution. Its bench-stable form simplifies storage and handling in medicinal chemistry applications.

Synthesis

Route1
- 98-88-4
- 443-48-1
- ~86%
- In-stock
  
  13182-89-3
References
- Indian Journal of Chemistry - Section B Organic and Medicinal Chemistry, , vol. 48, # 11 p. 1571 - 1576
Route2
- 443-48-1
- In-stock
  
  65-85-0
- ~37%
- In-stock
  
  13182-89-3
References
- European Journal of Medicinal Chemistry, , vol. 32, # 12 p. 995 - 1000

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

Quality Control

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Computational Chemistry Data

TPSA 87.26
LogP 1.95672
H_Acceptors 6
H_Donors 0
Rotatable_Bonds 5

Other Classifications

Analytical Science Drug Impurity Reference Substance Other Drugs Other impurity

Biochemistry Biochemicals and Reagents Pharmaceutical Research Reagents Antimicrobial Ingredients

Biochemistry Biochemicals and Reagents Pharmaceutical Research Reagents Antiparasitic Ingredients, Antiprotozoal Ingredients, Antihelminthic Ingredients

Biochemistry Pharmaceutical Development and Drug Discovery Research Pharmaceutical Research Reagents Antimicrobial Ingredients

Biochemistry Pharmaceutical Development and Drug Discovery Research Pharmaceutical Research Reagents Antiparasitic Ingredients, Antiprotozoal Ingredients, Antihelminthic Ingredients

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Metronidazole Benzoate

CAS No. 13182-89-3

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