CAS RN: 749900-93-4
2,7-Bis(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-9,9-didodecylfluorene
Product Availability
Choose a grade to view its available package options.
5 package records5 with current stock1 grade group
| Batch No. | Package | Availability | Warehouse | Inquiry |
|---|---|---|---|---|
| Batchno.20250606 | 100mg | In stock | Shanghai, Shenzhen, Tianjin | Inquiry |
| Batchno.20250116 | 1g | In stock | Shanghai | Inquiry |
| Batchno.20251004 | 200mg / 1g / 5g | Confirm by inquiry | Shanghai, Shandong | Inquiry |
| Batchno.20250325 | 250mg | In stock | Shanghai, Shenzhen, Tianjin | Inquiry |
| Batchno.20250128 | 5g | In stock | Shanghai, Shenzhen | Inquiry |
- Product code: ICTB4624
- Purity/Analytical Methods: >98.0%(HPLC)
749900-93-4 / 2-[9,9-didodecyl-7-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)fluoren-2-yl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
Basic Information
CAS
749900-93-4
Multi CAS
No
Molecular Formula
B2C49H80O4
Molecular Weight
754.800000
Exact Mass
754.624271
InChI
InChI=1S/C49H80B2O4/c1-11-13-15-17-19-21-23-25-27-29-35-49(36-30-28-26-24-22-20-18-16-14-12-2)43-37-39(50-52-45(3,4)46(5,6)53-50)31-33-41(43)42-34-32-40(38-44(42)49)51-54-47(7,8)48(9,10)55-51/h31-34,37-38H,11-30,35-36H2,1-10H3
InChIKey
GFPPDTSBPULCFW-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
55
Aromatic heavy atom count
12
Fraction Csp3
0.76
Rotatable bonds
24
H-bond acceptors
4
Molar refractivity
237.01
TPSA
36.92
LogP / Solubility
WLOGP
13.17
MLOGP
11.66
XLogP3
13.17
Consensus LogP
12.67
Log S (ESOL)
-11.4
Class (ESOL)
Insoluble
Log S (Ali)
-15.26
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-18.38
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)
2.03
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
Customers Also Viewed
-
2,7-Bis(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-9,9-didecylfluorene
- CAS RN: 711026-06-1
- Product Code: SSC-180789
-
2,7-Bis(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-9,9-di-n-octylfluorene
- CAS RN: 196207-58-6
- Product Code: SSC-092701
-
2,7-Bis(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-9,9-dihexylfluorene
- CAS RN: 254755-24-3
- Product Code: SSC-121442
-
2,7-Bis(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-9,9′-spirobi[9H-fluorene]
- CAS RN: 728911-52-2
- Product Code: SSC-182373
-
4,4,5,5-Tetramethyl-2-[10-(1-naphthyl)anthracen-9-yl]-1,3,2-dioxaborolane
- CAS RN: 1149804-35-2
- Product Code: SSC-014671
-
4,4,5,5-Tetramethyl-2-[4-(10-phenylanthracen-9-yl)phenyl]-1,3,2-dioxaborolane
- CAS RN: 1143576-84-4
- Product Code: SSC-014184
![CAS 728911-52-2 2,7-Bis(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-9,9′-spirobi[9H-fluorene] molecular structure](https://starshinechemical.com/wp-content/uploads/2022/03/b5656-jpgcontextbwfzdgvyfhjvb3r8mzg0nth8aw1hz2uvanblz3xozmuvadlklzg5mjkymte1mtq5mtavqju2ntyuanbnfgyzm2nkymy3zty4ndhjn2mzzgnkoti2n2fiymmzotk4m2jhzgewy2exnwu5owy4mmmxndy1mtringvhytbkmdc.jpeg)
![CAS 1149804-35-2 4,4,5,5-Tetramethyl-2-[10-(1-naphthyl)anthracen-9-yl]-1,3,2-dioxaborolane molecular structure](https://starshinechemical.com/wp-content/uploads/2022/03/t3306-jpgcontextbwfzdgvyfhjvb3r8ndeyotr8aw1hz2uvanblz3xozjevadm1lzg5mzi2nzawndyymzgvvdmzmdyuanbnfduzntuzn2jkywq4yjlioddkody1mdq1m2zmytbizmiymwuynjk2nzc2mdu2n2nhmdq1yjbknwnhyzy5zwmxywe.jpeg)
![CAS 1143576-84-4 4,4,5,5-Tetramethyl-2-[4-(10-phenylanthracen-9-yl)phenyl]-1,3,2-dioxaborolane molecular structure](https://starshinechemical.com/wp-content/uploads/2022/03/t3276-jpgcontextbwfzdgvyfhjvb3r8mzqyntz8aw1hz2uvanblz3xontkvagnjlzg5mzi2njg3mzu1mtgvvdmynzyuanbnfgrhzwewnmmznjy2mgniotm5odawowiwnjkwytc4yzexowixnzc5ndi4yzuzzwnkyzmwm2y0zwuxzdc0zju2mjg.jpeg)