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CAS 597554-03-5 10-(2-Naphthyl)anthracene-9-boronic Acid (contains varying amounts of Anhydride) molecular structure lightbox
CAS RN: 597554-03-5

10-(2-Naphthyl)anthracene-9-boronic Acid (contains varying amounts of Anhydride)

Product Availability

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4 package records3 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20251028 1g In stock Shanghai Inquiry
Batchno.20260508 1g / 5g Out of stock 5-7 business days Inquiry
Batchno.20250325 25g In stock Shanghai Inquiry
Batchno.20260619 5g In stock Shanghai, Shenzhen, Tianjin, Wuhan, Chengdu Inquiry
  • Product code: SSC-168292
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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: 10g
  • Available purity: ≥97%
  • 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 597554-03-5
Pack Size Recorded Purity Available Qty Ship From Inquiry
10g ≥97% 0 Out of Stock Hong Kong Inquiry

597554-03-5 / (10-naphthalen-2-ylanthracen-9-yl)boronic acid

Standard CAS: 597554-03-5 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
597554-03-5
Multi CAS
No
Molecular Formula
BC24H17O2
Molecular Weight
348.200000
Exact Mass
348.132160
InChI
InChI=1S/C24H17BO2/c26-25(27)24-21-11-5-3-9-19(21)23(20-10-4-6-12-22(20)24)18-14-13-16-7-1-2-8-17(16)15-18/h1-15,26-27H
InChIKey
YGVDBZMVEURVOW-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
27
Aromatic heavy atom count
24
Rotatable bonds
2
H-bond acceptors
2
H-bond donors
2
Molar refractivity
114.22
TPSA
40.46

LogP / Solubility

WLOGP
4.49
MLOGP
3.97
XLogP3
4.49
Consensus LogP
4.32
Log S (ESOL)
-5.36
Class (ESOL)
Slightly soluble
Log S (Ali)
-5.66
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-5.89
Class (SILICOS-IT)
Slightly soluble

ADME

GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-1.65

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
3.5

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