CAS RN: 131276-24-9
1,8-Dibromoanthracene
Product Availability
Choose a grade to view its available package options.
2 package records2 with current stock1 grade group
- Product code: SSC-038039
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: 5g
- 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 |
|---|---|---|---|---|
| 5g | ≥95% | 0 Out of Stock | Shenzhen | Inquiry |
131276-24-9 / 1,8-dibromoanthracene
Basic Information
CAS
131276-24-9
Multi CAS
No
Molecular Formula
C14H8Br2
Molecular Weight
336.020000
Exact Mass
335.897230
SMILES
C1=CC2=CC3=C(C=C2C(=C1)Br)C(=CC=C3)Br
InChI
InChI=1S/C14H8Br2/c15-13-5-1-3-9-7-10-4-2-6-14(16)12(10)8-11(9)13/h1-8H
InChIKey
JQQFVBWHOMXEEA-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
16
Aromatic heavy atom count
14
Molar refractivity
76.85
TPSA
0.0000
LogP / Solubility
WLOGP
5.52
MLOGP
4.87
XLogP3
5.8
Consensus LogP
5.4
Log S (ESOL)
-6.05
Class (ESOL)
Insoluble
Log S (Ali)
-6.3
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-6.42
Class (SILICOS-IT)
Insoluble
ADME
GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-0.85
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
1.5
Customers Also Viewed
-
![CAS 128055-74-3 2,2′,7,7′-Tetrabromo-9,9′-spirobi[9H-fluorene] molecular structure](data:image/svg+xml,%3Csvg%20xmlns='http://www.w3.org/2000/svg'%20viewBox='0%200%200%200'%3E%3C/svg%3E)
2,2′,7,7′-Tetrabromo-9,9′-spirobi[9H-fluorene]
- CAS RN: 128055-74-3
- Product Code: SSC-035408
-
-
-
-
-
3-Bromo-1,1′:4′,1”-terphenyl
- CAS RN: 1762-87-4
- Product Code: ICTB6127
- Purity/Analytical method: >97.0%(GC)
![CAS 128055-74-3 2,2′,7,7′-Tetrabromo-9,9′-spirobi[9H-fluorene] molecular structure](https://starshinechemical.com/wp-content/uploads/2022/03/t2597-jpgcontextbwfzdgvyfhjvb3r8ndi5ntb8aw1hz2uvanblz3xomtyvadlmlzg5mzi2mda3mdkxntavvdi1otcuanbnfdyzmjgwmje0zmm5ytm4y2m0zgfkngrhowu4zjbhmmewmdfhnzdkyje4nmi5zdliywywy2u1zdvkndkxndixmdm.jpeg)
