![CAS 2092900-01-9 2,3′,6′,7-Tetrabromospiro[fluorene-9,9′-xanthene] molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/2092900-01-9.png)
CAS RN: 2092900-01-9
2,3′,6′,7-Tetrabromospiro[fluorene-9,9′-xanthene]
Product Availability
Choose a grade to view its available package options.
1 package records1 with current stock1 grade group
| Batch No. | Package | Availability | Warehouse | Inquiry |
|---|---|---|---|---|
| Batchno.20251012 | 1g | In stock | Shanghai, Shandong | Inquiry |
- Product code: SSC-099109
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
Reference Pack Sizes
Reference pack sizes are shown below. Final availability, packaging and delivery schedule are confirmed by inquiry.
| Pack Size | Recorded Purity | Available Qty | Ship From | Inquiry |
|---|---|---|---|---|
| 1g | ＞95% | 0 Out of Stock | Shenzhen | Inquiry |
2092900-01-9 / 2,3',6',7-tetrabromospiro[fluorene-9,9'-xanthene]
Basic Information
CAS
2092900-01-9
Multi CAS
No
Molecular Formula
C25H12Br4O
Molecular Weight
648.000000
Exact Mass
647.758070
SMILES
C1=CC2=C(C=C1Br)C3(C4=C(C=C(C=C4)Br)OC5=C3C=CC(=C5)Br)C6=C2C=CC(=C6)Br
InChI
InChI=1S/C25H12Br4O/c26-13-1-5-17-18-6-2-14(27)10-22(18)25(21(17)9-13)19-7-3-15(28)11-23(19)30-24-12-16(29)4-8-20(24)25/h1-12H
InChIKey
NPVOSASTADZFPG-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
30
Aromatic heavy atom count
24
Fraction Csp3
0.04
H-bond acceptors
1
Molar refractivity
134.62
TPSA
9.23
LogP / Solubility
WLOGP
9.21
MLOGP
8.15
XLogP3
9
Consensus LogP
8.79
Log S (ESOL)
-10.25
Class (ESOL)
Insoluble
Log S (Ali)
-11.52
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-11.51
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)
-0.14
Drug-likeness / Medicinal Chemistry
Lipinski
No
Ghose
No
Veber
Yes
Egan
No
Muegge
No
Bioavailability score
0.17
Leadlikeness
No
Synthetic Accessibility
5
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