CAS RN: 105906-36-3
MONOBROMODIBENZO-PARA-DIOXIN
Product Availability
Choose a grade to view its available package options.
1 package records1 with current stock1 grade group
| Batch No. | Package | Availability | Warehouse | Lead Time | Inquiry |
|---|---|---|---|---|---|
| Batchno.20250401 | 250mg / 1g / 5g / 25g | Confirm by inquiry | Shandong | 5-7 business days | Inquiry |
- Product code: SSC-007558
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
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 | ＞97% | 0 Out of Stock | Shenzhen | Inquiry |
105906-36-3 / 2-bromodibenzo-p-dioxin
2-Bromooxanthrene | 2-bromodibenzo-p-dioxin | 2-Bromodibenzo[b,e][1,4]dioxine
Basic Information
CAS
105906-36-3
Multi CAS
Yes
Molecular Formula
C12H7BrO2
Molecular Weight
263.090000
Exact Mass
261.962940
SMILES
C1=CC=C2C(=C1)OC3=C(O2)C=C(C=C3)Br
InChI
InChI=1S/C12H7BrO2/c13-8-5-6-11-12(7-8)15-10-4-2-1-3-9(10)14-11/h1-7H
InChIKey
GSUCEGNAROQSGU-UHFFFAOYSA-N
Synonyms
2-Bromooxanthrene
2-bromodibenzo-p-dioxin
2-Bromodibenzo[b,e][1,4]dioxine
2-bromo-dibenzo-dioxin
MFCD28968963
Computed Properties
Structural Parameters
Heavy atom count
15
Aromatic heavy atom count
12
H-bond acceptors
2
Molar refractivity
60.73
TPSA
18.46
LogP / Solubility
WLOGP
4.35
MLOGP
3.83
XLogP3
5.1
Consensus LogP
4.43
Log S (ESOL)
-4.8
Class (ESOL)
Slightly soluble
Log S (Ali)
-4.86
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-4.98
Class (SILICOS-IT)
Slightly soluble
ADME
GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-1.24
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
1.5
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