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CAS 317802-08-7 9 9-DIOCTYLFLUORENE-2 7-BIS(TRIMETHYLBO& molecular structure lightbox
CAS RN: 317802-08-7

9 9-DIOCTYLFLUORENE-2 7-BIS(TRIMETHYLBO&

Product Availability

Choose a grade to view its available package options.

6 package records5 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20250109 1g In stock Shanghai, Shenzhen, Tianjin Inquiry
Batchno.20250520 1g In stock Shanghai Inquiry
Batchno.20251225 250mg In stock Shanghai, Shenzhen, Chengdu Inquiry
Batchno.20250504 25g In stock Shanghai Inquiry
Batchno.20250508 5g In stock Shanghai, Shenzhen Inquiry
Batchno.20260208 5g Out of stock 8-10 business days Inquiry
  • Product code: SSC-137201
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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: ≥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 317802-08-7
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ≥97% 0 Out of Stock Beijing Inquiry

317802-08-7 / 2-[7-(1,3,2-dioxaborinan-2-yl)-9,9-dioctylfluoren-2-yl]-1,3,2-dioxaborinane

Standard CAS: 317802-08-7 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
317802-08-7
Multi CAS
Yes
Molecular Formula
B2C35H52O4
Molecular Weight
558.400000
Exact Mass
558.405171
InChI
InChI=1S/C35H52B2O4/c1-3-5-7-9-11-13-21-35(22-14-12-10-8-6-4-2)33-27-29(36-38-23-15-24-39-36)17-19-31(33)32-20-18-30(28-34(32)35)37-40-25-16-26-41-37/h17-20,27-28H,3-16,21-26H2,1-2H3
InChIKey
KAYXDWIILRESPY-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
41
Aromatic heavy atom count
12
Fraction Csp3
0.66
Rotatable bonds
16
H-bond acceptors
4
Molar refractivity
172.46
TPSA
36.92

LogP / Solubility

WLOGP
7.72
MLOGP
6.84
XLogP3
7.72
Consensus LogP
7.43
Log S (ESOL)
-7.33
Class (ESOL)
Insoluble
Log S (Ali)
-9.71
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-11.62
Class (SILICOS-IT)
Insoluble

ADME

GI absorption
Low
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
No
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-0.65

Drug-likeness / Medicinal Chemistry

Lipinski
No
Ghose
No
Veber
No
Egan
No
Muegge
No
Bioavailability score
0.17
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
5

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