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(5-Cyclopropyl-3-(2,6-dichlorophenyl)isoxazol-4-yl)methanol

  • CAS No. 946426-89-7

  • Cat. No. CS-0112901
  • Purity≥97%
  • MDL No.MFCD11046189
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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.

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

(5-Cyclopropyl-3-(2,6-dichlorophenyl)isoxazol-4-yl)methanol|CS-0112901

Structure of 946426-89-7

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Description

This cyclopropyl-substituted isoxazole methanol features a sterically hindered, electron-deficient core paired with a reactive hydroxymethyl group. The para-dichlorophenyl moiety enhances lipophilicity and metabolic stability, while the cyclopropyl ring contributes conformational rigidity. This structure enables direct incorporation into bioactive scaffolds via coupling reactions under standard conditions.

Application

(5-Cyclopropyl-3-(2,6-dichlorophenyl)isoxazol-4-yl)methanol serves as a versatile building block for heterocyclic synthesis, enabling efficient access to bioactive scaffolds. The isoxazole core exhibits robust bench stability and tolerates a range of functional groups, facilitating downstream transformations such as derivatization at the alcohol moiety. Its structural motif is well-documented in medicinal chemistry applications, particularly in the development of kinase inhibitors and CNS-targeted compounds.

General Information

  • CAS No. 946426-89-7
  • Cat. No. CS-0112901
  • Purity ≥97%
  • MDL No. MFCD11046189
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₃H₁₁Cl₂NO₂
  • Molecular Weight 284.14
  • Synonym(s) CYCLOPROPYL-3-(2,6-DICHLOROPHENYL)ISOXAZOL-4-YL)METHANOL
  • SMILES OCC1=C(C2CC2)ON=C1C3=C(Cl)C=CC=C3Cl

Computational Chemistry Data

  • TPSA   46.26
  • LogP   4.0181
  • H_Acceptors   3
  • H_Donors   1
  • Rotatable_Bonds   3

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 : 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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