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CAS 943830-75-9 2-Fluoro-3,4-methylenedioxyphenylboronic acid molecular structure lightbox
CAS RN: 943830-75-9

2-Fluoro-3,4-methylenedioxyphenylboronic acid

Product Availability

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1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20251010 100mg / 250mg Out of stock 5-7 business days Inquiry
  • Product code: SSC-209132
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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: 1g
  • 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 943830-75-9
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ≥95% 0 Out of Stock Beijing Inquiry

943830-75-9 / (4-fluoro-1,3-benzodioxol-5-yl)boronic acid

Standard CAS: 943830-75-9 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
943830-75-9
Multi CAS
No
Molecular Formula
BC7FH6O4
Molecular Weight
183.930000
Exact Mass
184.034317
InChI
InChI=1S/C7H6BFO4/c9-6-4(8(10)11)1-2-5-7(6)13-3-12-5/h1-2,10-11H,3H2
InChIKey
IIUUBGPDUHFEQA-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
13
Aromatic heavy atom count
6
Fraction Csp3
0.14
Rotatable bonds
1
H-bond acceptors
4
H-bond donors
2
Molar refractivity
42.35
TPSA
58.92

LogP / Solubility

WLOGP
-0.77
MLOGP
-0.68
XLogP3
-0.77
Consensus LogP
-0.74
Log S (ESOL)
-0.77
Class (ESOL)
Very soluble
Log S (Ali)
-0.52
Class (Ali)
Very soluble
Log S (SILICOS-IT)
-0.34
Class (SILICOS-IT)
Very soluble

ADME

GI absorption
Low
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-4.39

Drug-likeness / Medicinal Chemistry

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

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