CAS RN: 908142-03-0
3-(Hydroxymethyl)-4-methoxyphenylboronic Acid (contains varying amounts of Anhydride)
Product Availability
Choose a grade to view its available package options.
3 package records3 with current stock1 grade group
- Product code: SSC-203463
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: 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.
| Pack Size | Recorded Purity | Available Qty | Ship From | Inquiry |
|---|---|---|---|---|
| 25g | ＞97% | 0 Out of Stock | Beijing | Inquiry |
908142-03-0 / [3-(hydroxymethyl)-4-methoxyphenyl]boronic acid
Basic Information
CAS
908142-03-0
Multi CAS
No
Molecular Formula
BC8H11O4
Molecular Weight
181.980000
Exact Mass
182.075039
InChI
InChI=1S/C8H11BO4/c1-13-8-3-2-7(9(11)12)4-6(8)5-10/h2-4,10-12H,5H2,1H3
InChIKey
DOQUCBSZQOPLGT-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
13
Aromatic heavy atom count
6
Fraction Csp3
0.25
Rotatable bonds
3
H-bond acceptors
4
H-bond donors
3
Molar refractivity
48.74
TPSA
69.92
LogP / Solubility
WLOGP
-1.13
MLOGP
-1
XLogP3
-1.13
Consensus LogP
-1.09
Log S (ESOL)
-0.4
Class (ESOL)
Very soluble
Log S (Ali)
-0.23
Class (Ali)
Very soluble
Log S (SILICOS-IT)
-0.26
Class (SILICOS-IT)
Very soluble
ADME
GI absorption
Low
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-4.63
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 932378-94-4 [3,5-Bis(ethoxycarbonyl)phenyl]boronic Acid (contains varying amounts of Anhydride) molecular structure](data:image/svg+xml,%3Csvg%20xmlns='http://www.w3.org/2000/svg'%20viewBox='0%200%200%200'%3E%3C/svg%3E)
[3,5-Bis(ethoxycarbonyl)phenyl]boronic Acid (contains varying amounts of Anhydride)
- CAS RN: 932378-94-4
- Product Code: SSC-207237
-
4-Fluoro-2-methylphenylboronic Acid (contains varying amounts of Anhydride)
- CAS RN: 139911-29-8
- Product Code: SSC-050408
-
4-Fluoro-2-(trifluoromethyl)phenylboronic Acid (contains varying amounts of Anhydride)
- CAS RN: 182344-16-7
- Product Code: SSC-083718
-
2-Fluoro-6-methoxyphenylboronic Acid (contains varying amounts of Anhydride)
- CAS RN: 78495-63-3
- Product Code: SSC-187882
-
4-Hydroxy-2-methylphenylboronic Acid (contains varying amounts of Anhydride)
- CAS RN: 493035-82-8
- Product Code: SSC-155652
-
5-Formyl-2-methoxyphenylboronic Acid (contains varying amounts of Anhydride)
- CAS RN: 127972-02-5
- Product Code: SSC-035325
![CAS 932378-94-4 [3,5-Bis(ethoxycarbonyl)phenyl]boronic Acid (contains varying amounts of Anhydride) molecular structure](https://starshinechemical.com/wp-content/uploads/2022/03/b6032-jpgcontextbwfzdgvyfhjvb3r8mjg3ntl8aw1hz2uvanblz3xoyjavagi3lzg5mjkymjc4otg5mtavqjywmziuanbnfdnknwflmzi1owyxymq5yjflzwe3ytllnzhlnji5n2iwywzjntuwzwizzdczode1nwe4ntbiyzzizdewnze3ndm.jpeg)
