CAS RN: 1067228-90-3
4-CHLORO-2,6-DIMETHOXY PHENYLBORONIC ACID
Product Availability
Choose a grade to view its available package options.
1 package records1 with current stock1 grade group
| Batch No. | Package | Availability | Warehouse | Inquiry |
|---|---|---|---|---|
| Batchno.20260327 | 250mg | In stock | Shanghai | Inquiry |
- Product code: SSC-008256
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, 0.1g, 0.25g, 5g
- Available purity: ≥95%
- Inventory rows with stock: 2
- 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 | -- | 4 In Stock | Beijing | Inquiry |
| 1g | ≥95% | 4 In Stock | Shanghai | Inquiry |
| 0.1g | -- | 0 Out of Stock | Shanghai | Inquiry |
| 0.1g | ≥95% | 0 Out of Stock | Hong Kong | Inquiry |
| 0.25g | -- | 0 Out of Stock | Beijing | Inquiry |
| 0.25g | ≥95% | 0 Out of Stock | Shenzhen | Inquiry |
| 5g | -- | 0 Out of Stock | Beijing | Inquiry |
| 5g | ≥95% | 0 Out of Stock | Beijing | Inquiry |
1067228-90-3 / (4-chloro-2,6-dimethoxyphenyl)boronic acid
(4-Chloro-2,6-dimethoxyphenyl)boronic acid | 4-Chloro-2,6-dimethoxy phenylboronic acid | 4-Chloro-2,6-dimethoxyphenylboronic acid
Basic Information
CAS
1067228-90-3
Multi CAS
No
Molecular Formula
C8H10BClO4
Molecular Weight
216.430000
Exact Mass
216.036067
SMILES
B(C1=C(C=C(C=C1OC)Cl)OC)(O)O
InChI
InChI=1S/C8H10BClO4/c1-13-6-3-5(10)4-7(14-2)8(6)9(11)12/h3-4,11-12H,1-2H3
InChIKey
VNYKXENLVGSAOC-UHFFFAOYSA-N
Synonyms
(4-Chloro-2,6-dimethoxyphenyl)boronic acid
4-Chloro-2,6-dimethoxy phenylboronic acid
4-Chloro-2,6-dimethoxyphenylboronic acid
MFCD04037225
SCHEMBL29957585
Computed Properties
Structural Parameters
Heavy atom count
14
Aromatic heavy atom count
6
Fraction Csp3
0.25
Rotatable bonds
3
H-bond acceptors
4
H-bond donors
2
Molar refractivity
54.38
TPSA
58.92
LogP / Solubility
WLOGP
0.04
MLOGP
0.03
XLogP3
0.04
Consensus LogP
0.04
Log S (ESOL)
-1.32
Class (ESOL)
Soluble
Log S (Ali)
-1.36
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.46
Class (SILICOS-IT)
Soluble
ADME
GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-4.01
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
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