2-(6-Oxo-1,6-dihydro-9H-purin-9-yl)acetic acid

Name: 2-(6-Oxo-1,6-dihydro-9H-purin-9-yl)acetic acid
Brand: ChemScene
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CAS No. 6298-53-9
Cat. No. CS-0062126
Purity≥98%
MDL No.MFCD20640752

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2-(6-Oxo-1,6-dihydro-9H-purin-9-yl)acetic acid|CS-0062126

Structure of 6298-53-9

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Description

This purine derivative features a carboxylic acid side chain at the 2-position of a 9-oxopurine core, enabling direct conjugation or derivatization in nucleoside analog synthesis. The electron-deficient purine scaffold enhances reactivity in coupling processes, while the bench-stable acetic acid moiety simplifies handling and purification under standard conditions.

Application

2-(6-Oxo-1,6-dihydro-9H-purin-9-yl)acetic acid serves as a versatile building block for purine-based scaffolds, enabling efficient conjugation via its carboxylic acid functionality. The molecule exhibits bench stability and compatibility with standard coupling reactions, facilitating incorporation into nucleoside analogs and bioactive heterocycles. Its functional group tolerance supports use in medicinal chemistry campaigns targeting kinase inhibitors and antiviral agents.

General Information

CAS No. 6298-53-9
Cat. No. CS-0062126
Purity ≥98%
MDL No. MFCD20640752
Storage Store at room temperature
Shipping Room temperature in continental US; may vary elsewhere.
Molecular Formula C₇H₆N₄O₃
Molecular Weight 194.15
Synonym(s) 2-(6-Oxo-1H-purin-9(6H)-yl)acetic acid
SMILES O=C(O)CN1C=NC2=C1N=CNC2=O

Computational Chemistry Data

TPSA 100.87
LogP -0.7958
H_Acceptors 5
H_Donors 2
Rotatable_Bonds 2

Safety Information

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Signal Word : N/A	UN#: N/A
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Hazard Statements : N/A
Precautionary Statements : N/A

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Other Classifications

Building Blocks Skeleton Aromatic heterocycle compounds Purine compounds

Key Words

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2-(6-Oxo-1,6-dihydro-9H-purin-9-yl)acetic acid

CAS No. 6298-53-9

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