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CAS 84243-02-7 1-Chloro-3-(6-fluoro-benzo[d]isoxazol-3-yl)-propane molecular structure lightbox
CAS RN: 84243-02-7

1-Chloro-3-(6-fluoro-benzo[d]isoxazol-3-yl)-propane

Product Availability

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4 package records4 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20260220 100mg In stock Shanghai Inquiry
Batchno.20250828 100mg / 250mg / 1g Confirm by inquiry Shanghai Inquiry
Batchno.20250123 1g In stock Shanghai Inquiry
Batchno.20251231 250mg In stock Shanghai Inquiry
  • Product code: SSC-191803
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Historical Factory Record

Historical Supply Reference

This product has historical factory records. Recorded pack sizes and purity can be used as a supply reference, while project-specific availability is confirmed by inquiry.

  • Pack sizes on record: 0.25g
  • Available purity: ≥95%
  • Inventory rows with stock: 0
  • Bulk packaging: confirmed by inquiry
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Reference Pack Sizes

Reference pack sizes are shown below. Final availability, packaging and delivery schedule are confirmed by inquiry.

Recorded sizes, purity and stock details for CAS 84243-02-7
Pack Size Recorded Purity Available Qty Ship From Inquiry
0.25g ≥95% 0 Out of Stock Shenzhen Inquiry

84243-02-7 / 3-(3-chloropropyl)-6-fluoro-1,2-benzoxazole

Standard CAS: 84243-02-7 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
84243-02-7
Multi CAS
No
Molecular Formula
C10H9CLFNO
Molecular Weight
213.630000
Exact Mass
213.035670
InChI
InChI=1S/C10H9ClFNO/c11-5-1-2-9-8-4-3-7(12)6-10(8)14-13-9/h3-4,6H,1-2,5H2
InChIKey
XONBKLFCLPGIPC-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
14
Aromatic heavy atom count
9
Fraction Csp3
0.3
Rotatable bonds
3
H-bond acceptors
2
Molar refractivity
53.01
TPSA
26.03

LogP / Solubility

WLOGP
3.14
MLOGP
2.76
XLogP3
3.1
Consensus LogP
3
Log S (ESOL)
-3.42
Class (ESOL)
Poorly soluble
Log S (Ali)
-3.58
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-4.01
Class (SILICOS-IT)
Slightly soluble

ADME

GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-1.8

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
1.5

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