(4-Cyclopropyl-6-methoxypyrimidin-5-yl)boronic acid

Name: (4-Cyclopropyl-6-methoxypyrimidin-5-yl)boronic acid
Brand: ChemScene
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CAS No. 1798304-51-4
Cat. No. CS-0435474
Purity≥97%
MDL No.MFCD31556945

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(4-Cyclopropyl-6-methoxypyrimidin-5-yl)boronic acid|CS-0435474

Structure of 1798304-51-4

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General Information

CAS No. 1798304-51-4
Cat. No. CS-0435474
Purity ≥97%
MDL No. MFCD31556945
Storage 4°C, sealed storage, away from moisture
Shipping Room temperature in continental US; may vary elsewhere.
Molecular Formula C₈H₁₁BN₂O₃
Molecular Weight 194.00
Synonym(s) None
SMILES OB(C1=C(OC)N=CN=C1C2CC2)O

Description

This boronate moiety integrates a cyclopropyl-substituted pyrimidine scaffold, offering enhanced metabolic stability and favorable solubility. The methoxy group at C6 modulates electronic properties, enabling efficient coupling in Suzuki-Miyaura reactions under standard conditions. Designed for streamlined synthesis of bioactive heterocycles, this reagent delivers high functional group tolerance and bench-stable handling.

Application

(4-Cyclopropyl-6-methoxypyrimidin-5-yl)boronic acid serves as a versatile building block in Suzuki-Miyaura cross-coupling reactions, enabling efficient construction of biaryl and heteroaryl scaffolds. Its pyrimidine core provides enhanced metabolic stability and favorable physicochemical properties, while the cyclopropyl and methoxy substituents offer tunable steric and electronic profiles. The boronic acid moiety exhibits good bench stability and compatibility with diverse functional groups, facilitating straightforward purification and integration into complex molecular architectures common in medicinal chemistry and agrochemical research.

Safety Information

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GHS Pictogram :	GHS No : GHS07
Signal Word : Warning	UN#: N/A
Class : N/A	Packing Group : N/A
Hazard Statements : H315-H319
Precautionary Statements : P264-P280-P302+P352-P362+P364

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Computational Chemistry Data

TPSA 75.47
LogP -0.9576
H_Acceptors 5
H_Donors 2
Rotatable_Bonds 3

Other Classifications

Building Blocks Skeleton Aromatic heterocycle compounds Pyrimidine compounds

Building Blocks Skeleton Fatty ring compounds Cyclopropane compounds

Drug Discovery Cancer USP1

Key Words

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(4-Cyclopropyl-6-methoxypyrimidin-5-yl)boronic acid

CAS No. 1798304-51-4

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