5,6-Dihydroxy-2-phenylpyrimidine-4-carboxylic acid

Name: 5,6-Dihydroxy-2-phenylpyrimidine-4-carboxylic acid
Brand: ChemScene
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CAS No. 62222-38-2
Cat. No. CS-0156390
Molecule weight232.19
Purity≥95%
MDL No.MFCD09701383

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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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5,6-Dihydroxy-2-phenylpyrimidine-4-carboxylic acid|CS-0156390

Structure of 62222-38-2

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General Information

CAS No. 62222-38-2
Cat. No. CS-0156390
Purity ≥95%
MDL No. MFCD09701383
Storage 4°C, stored under nitrogen
Shipping Room temperature in continental US; may vary elsewhere.
Molecular Formula C₁₁H₈N₂O₄
Molecular Weight 232.19
Synonym(s) 5,6-DIHYDROXY-2-PHENYL-PYRIMIDINE-4-CARBOXYLIC ACID
SMILES C1=CC=C(C=C1)C2=NC(=C(C(=N2)C(=O)O)O)O

Description

5,6-Dihydroxy-2-phenylpyrimidine-4-carboxylic acid features a fused pyrimidine core with orthogonal hydroxyl and carboxylic acid functionalities, enabling robust conjugation in bioconjugation workflows. The phenyl substituent enhances π-stacking potential, while the electron-rich dihydroxy motif supports metal chelation and redox activity. This scaffold delivers high solubility in aqueous media and stability under standard bench conditions, facilitating integration into probe design and medicinal chemistry campaigns.

Application

5,6-Dihydroxy-2-phenylpyrimidine-4-carboxylic acid serves as a versatile heterocyclic building block for medicinal chemistry and materials science applications. Its ortho-diol functionality enables chelation and metal coordination, while the carboxylic acid group supports derivatization via amide or ester formation. The molecule exhibits bench stability and facilitates modular synthesis of pyrimidine-based scaffolds relevant to kinase inhibitors and bioactive ligands.

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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Computational Chemistry Data

TPSA 103.54
LogP 1.253
H_Acceptors 5
H_Donors 3
Rotatable_Bonds 2

Other Classifications

Building Blocks Skeleton Aromatic heterocycle compounds Pyrimidine compounds

Building Blocks Skeleton Aromatic ring compounds Benzene compounds

Key Words

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5,6-Dihydroxy-2-phenylpyrimidine-4-carboxylic acid

CAS No. 62222-38-2

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