CAS RN: 884336-44-1

2-(9,9′-Spirobi[fluoren]-7-yl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane

Product Availability

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6 package records5 with current stock2 grade groups
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250114 100g Out of stock Inquiry
Batchno.20250803 1g In stock Shanghai, Shenzhen, Tianjin, Wuhan, Chengdu Inquiry
Batchno.20251030 250mg In stock Shanghai, Chengdu Inquiry
Batchno.20250220 25g In stock Shanghai Inquiry
Batchno.20250429 5g In stock Shanghai, Shenzhen, Tianjin, Chengdu Inquiry
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250804 1g / 5g / 25g Confirm by inquiry Shanghai Inquiry
  • Product code: SSC-199050
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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: ≥98%
  • 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 884336-44-1
Pack Size Recorded Purity Available Qty Ship From Inquiry
10g ≥98% 0 Out of Stock Hong Kong Inquiry

884336-44-1 / 4,4,5,5-tetramethyl-2-(9,9'-spirobi[fluorene]-2-yl)-1,3,2-dioxaborolane

Standard CAS: 884336-44-1 Multi CAS: Yes

Basic Information

CAS
884336-44-1
Multi CAS
Yes
Molecular Formula
BC31H27O2
Molecular Weight
442.400000
Exact Mass
442.210410
InChI
InChI=1S/C31H27BO2/c1-29(2)30(3,4)34-32(33-29)20-17-18-24-23-13-7-10-16-27(23)31(28(24)19-20)25-14-8-5-11-21(25)22-12-6-9-15-26(22)31/h5-19H,1-4H3
InChIKey
VZMLUIPYIYNRGP-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
34
Aromatic heavy atom count
24
Fraction Csp3
0.23
Rotatable bonds
1
H-bond acceptors
2
Molar refractivity
138.46
TPSA
18.46

LogP / Solubility

WLOGP
6.33
MLOGP
5.6
XLogP3
6.33
Consensus LogP
6.09
Log S (ESOL)
-7.03
Class (ESOL)
Insoluble
Log S (Ali)
-7.76
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-7.91
Class (SILICOS-IT)
Insoluble

ADME

GI absorption
Low
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
No
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-0.92

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
No
Muegge
No
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
5.5

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