2-Chloro-5H-pyrrolo[3,2-d]pyrimidine-4-carboxylic acid

Name: 2-Chloro-5H-pyrrolo[3,2-d]pyrimidine-4-carboxylic acid
Brand: ChemScene
Availability: InStock
Rating: 5 (1 reviews)

CAS No. 2090149-31-6
Cat. No. CS-0436532
Purity≥95%
MDL No.None

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2-Chloro-5H-pyrrolo[3,2-d]pyrimidine-4-carboxylic acid|CS-0436532

Structure of 2090149-31-6

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Description

This pyrrolopyrimidine derivative features a chlorine substituent at the 2-position and a carboxylic acid group at the 4-position, enabling direct functionalization in heterocyclic synthesis. The electron-deficient core facilitates coupling reactions under mild conditions, while the carboxylic acid provides a handle for derivatization or salt formation.

Application

2-Chloro-5H-pyrrolo[3,2-d]pyrimidine-4-carboxylic acid serves as a versatile building block for purine-derived scaffolds in medicinal chemistry. Its carboxylic acid functionality enables direct amidation or esterification, while the chlorinated pyrrolopyrimidine core facilitates nucleophilic substitution and transition-metal-catalyzed coupling reactions. The compound exhibits good bench stability and compatibility with standard purification methods, making it well-suited for modular synthesis of kinase inhibitors and other bioactive heterocycles.

General Information

CAS No. 2090149-31-6
Cat. No. CS-0436532
Purity ≥95%
MDL No. None
Storage 4°C
Shipping Room temperature in continental US; may vary elsewhere.
Molecular Formula C₇H₄ClN₃O₂
Molecular Weight 197.58
Synonym(s) None
SMILES O=C(C1=C(NC=C2)C2=NC(Cl)=N1)O

Computational Chemistry Data

TPSA 78.87
LogP 1.3095
H_Acceptors 3
H_Donors 2
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-P330-P362+P364-P405-P501

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Other Classifications

Building Blocks Functional Group Carboxylic Acid

Building Blocks Skeleton Aromatic heterocycle compounds Pyrrole compounds

Building Blocks Skeleton Aromatic heterocycle compounds Pyrimidine compounds

Key Words

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2-Chloro-5H-pyrrolo[3,2-d]pyrimidine-4-carboxylic acid

CAS No. 2090149-31-6

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