CAS RN: 25487-66-5
3-Carboxyphenylboronic Acid (contains varying amounts of Anhydride)
Product Availability
Choose a grade to view its available package options.
5 package records5 with current stock1 grade group
| Batch No. | Package | Availability | Warehouse | Inquiry |
|---|---|---|---|---|
| Batchno.20250419 | 100g | In stock | Shanghai, Shandong, Guangdong, Chongqing | Inquiry |
| Batchno.20260204 | 1g | In stock | Shanghai, Shandong, Chongqing, Hebei | Inquiry |
| Batchno.20250901 | 25g | In stock | Shanghai, Shandong, Guangdong | Inquiry |
| Batchno.20250527 | 500g | In stock | Shandong | Inquiry |
| Batchno.20250107 | 5g | In stock | Shanghai, Shandong, Guangdong, Chongqing, Hebei | Inquiry |
- Product code: SSC-121451
Verified Factory Data
Supply Overview & Packaging Options
Packaging options, recorded purity, stock quantity and ship-from location below are generated from the current factory data table for this CAS.
- Pack sizes on record: 1g, 5g, 10g, 25g, 100g, 500g
- Available purity: ≥98%
- Inventory rows with stock: 1
- Bulk packaging: confirmed by inquiry
Available Pack Sizes & Stock
Specific stock quantities are shown below. Price is not displayed online and is confirmed by inquiry.
| Pack Size | Recorded Purity | Available Qty | Ship From | Inquiry |
|---|---|---|---|---|
| 1g | ≥98% | 5 In Stock | Shenzhen | Inquiry |
| 5g | ≥98% | 0 Out of Stock | Hong Kong | Inquiry |
| 10g | ≥98% | 0 Out of Stock | Shenzhen | Inquiry |
| 25g | ≥98% | 0 Out of Stock | Shenzhen | Inquiry |
| 100g | ≥98% | 0 Out of Stock | Shanghai | Inquiry |
| 500g | ≥98% | 0 Out of Stock | Shenzhen | Inquiry |
25487-66-5 / (3-formyloxyphenyl)boronic acid
Basic Information
CAS
25487-66-5
Multi CAS
No
Molecular Formula
C7H7BO4
Molecular Weight
165.940000
Exact Mass
166.043739
SMILES
B(C1=CC(=CC=C1)OC=O)(O)O
InChI
InChI=1S/C7H7BO4/c9-5-12-7-3-1-2-6(4-7)8(10)11/h1-5,10-11H
InChIKey
CGKZLXUMUJKVPS-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
12
Aromatic heavy atom count
6
Rotatable bonds
3
H-bond acceptors
4
H-bond donors
2
Molar refractivity
42.96
TPSA
66.76
LogP / Solubility
WLOGP
-1.1
MLOGP
-0.97
XLogP3
-1.1
Consensus LogP
-1.06
Log S (ESOL)
-0.35
Class (ESOL)
Very soluble
Log S (Ali)
-0.13
Class (Ali)
Very soluble
Log S (SILICOS-IT)
-0.19
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)
-4.51
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
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![CAS 815581-79-4 2-[(2,2,6,6-Tetramethyl-1-piperidyl)methyl]phenylboronic Acid (contains varying amounts of Anhydride) molecular structure](https://starshinechemical.com/wp-content/uploads/2022/03/t2908-jpgcontextbwfzdgvyfhjvb3r8ndqyndh8aw1hz2uvanblz3xoytyvadyylzg5mzi2ndk5mjy2odyvvdi5mdguanbnfdy3zmq5ywm1m2ywmzzimzazntgxzta4yji0y2e3m2jhm2jkyzhhztayzji5nmniodnjnzq2njyyodk5ogu1y2i.jpeg)
