CAS RN: 108847-20-7
Dibenzothiophene-4-boronic Acid (contains varying amounts of Anhydride)
Product Availability
Choose a grade to view its available package options.
13 package records11 with current stock3 grade groups
| Batch No. | Package | Availability | Warehouse | Lead Time | Inquiry |
|---|---|---|---|---|---|
| Batchno.20251127 | 100g | In stock | Shanghai, Shenzhen | Inquiry | |
| Batchno.20260308 | 10g | In stock | Shanghai, Shenzhen | Inquiry | |
| Batchno.20250624 | 1g | In stock | Shanghai, Shenzhen, Chengdu | Inquiry | |
| Batchno.20250424 | 25g | In stock | Shanghai, Shenzhen, Tianjin, Wuhan | Inquiry | |
| Batchno.20251027 | 500g | Out of stock | Inquiry | ||
| Batchno.20251023 | 5g | In stock | Shanghai, Shenzhen, Tianjin, Wuhan, Chengdu | Inquiry |
- Product code: SSC-010070
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, 5g, 10g, 25g
- 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.
108847-20-7 / dibenzothiophen-4-ylboronic acid
Dibenzothiophene-4-boronic acid | DTXSID50370220 | RefChem:1083370
Basic Information
CAS
108847-20-7
Multi CAS
Yes
Molecular Formula
C12H9BO2S
Molecular Weight
228.080000
Exact Mass
228.041631
SMILES
B(C1=C2C(=CC=C1)C3=CC=CC=C3S2)(O)O
InChI
InChI=1S/C12H9BO2S/c14-13(15)10-6-3-5-9-8-4-1-2-7-11(8)16-12(9)10/h1-7,14-15H
InChIKey
GOXNHPQCCUVWRO-UHFFFAOYSA-N
Synonyms
Dibenzothiophene-4-boronic acid
DTXSID50370220
RefChem:1083370
DTXCID90321256
4-Dibenzothiopheneboronic acid
Computed Properties
Structural Parameters
Heavy atom count
16
Aromatic heavy atom count
13
Rotatable bonds
1
H-bond acceptors
3
H-bond donors
2
Molar refractivity
69.16
TPSA
40.46
LogP / Solubility
WLOGP
1.73
MLOGP
1.53
XLogP3
1.73
Consensus LogP
1.66
Log S (ESOL)
-2.88
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.68
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.7
Class (SILICOS-IT)
Moderately soluble
ADME
GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2.88
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
1.5
Customers Also Viewed
-
Quinolin-6-ylboronic Acid (contains varying amounts of Anhydride)
- CAS RN: 376581-24-7
- Product Code: SSC-145074
-
(5-Formylthiophen-3-yl)boronic Acid (contains varying amounts of Anhydride)
- CAS RN: 175592-59-3
- Product Code: SSC-077031
-
9-Phenyl-3-[2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]-9H-carbazole
- CAS RN: 1628817-49-1
- Product Code: ICTP2772
- Purity/Analytical method: >95.0%(T)(HPLC)
-
(1-Methyl-1H-pyrazol-5-yl)boronic Acid (contains varying amounts of Anhydride)
- CAS RN: 720702-41-0
- Product Code: SSC-181603
-
Indazole-4-boronic Acid (contains varying amounts of Anhydride)
- CAS RN: 1023595-17-6
- Product Code: SSC-003633
-
2-Chloropyridine-4-boronic Acid (contains varying amounts of Anhydride)
- CAS RN: 458532-96-2
- Product Code: SSC-153467
![CAS 1628817-49-1 9-Phenyl-3-[2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]-9H-carbazole molecular structure](https://starshinechemical.com/wp-content/uploads/2022/03/p2772-jpgcontextbwfzdgvyfhjvb3r8mjq3mzh8aw1hz2uvanblz3xondcvagjjlzkxnzu1mtm2nje0nzavudi3nziuanbnfdk2mwu2zjyyzwnmmzbiywm1zdg3mmi2ytg1mmjhodawywuxm2mzztg5odazzgjhnzm2mgeyodc5n2i1oteyyjk.jpeg)
