CAS RN: 445264-60-8
3-Methoxy-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine
Product Availability
Choose a grade to view its available package options.
6 package records6 with current stock1 grade group
| Batch No. | Package | Availability | Warehouse | Inquiry |
|---|---|---|---|---|
| Batchno.20260526 | 100g | In stock | Shenzhen, Tianjin | Inquiry |
| Batchno.20250209 | 10g | In stock | Shanghai, Shenzhen, Tianjin | Inquiry |
| Batchno.20251116 | 1g | In stock | Shanghai, Tianjin, Wuhan, Chengdu | Inquiry |
| Batchno.20250912 | 250mg | In stock | Shanghai, Tianjin | Inquiry |
| Batchno.20250719 | 25g | In stock | Tianjin | Inquiry |
| Batchno.20260506 | 5g | In stock | Shanghai, Tianjin | Inquiry |
- Product code: SSC-152549
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.
445264-60-8 / 3-methoxy-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine
Basic Information
CAS
445264-60-8
Multi CAS
No
Molecular Formula
BC12H18NO3
Molecular Weight
235.090000
Exact Mass
235.137974
InChI
InChI=1S/C12H18BNO3/c1-11(2)12(3,4)17-13(16-11)9-6-10(15-5)8-14-7-9/h6-8H,1-5H3
InChIKey
HENXUFOAGXNWKH-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
17
Aromatic heavy atom count
6
Fraction Csp3
0.58
Rotatable bonds
2
H-bond acceptors
4
Molar refractivity
66.51
TPSA
40.58
LogP / Solubility
WLOGP
1.39
MLOGP
1.23
XLogP3
1.39
Consensus LogP
1.34
Log S (ESOL)
-2.3
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.49
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.58
Class (SILICOS-IT)
Moderately 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)
-3.17
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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![CAS 454185-98-9 Methyl 2-[4-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]acetate molecular structure](https://starshinechemical.com/wp-content/uploads/2022/03/m3236-jpgcontextbwfzdgvyfhjvb3r8mza4njf8aw1hz2uvanblz3xoywqvagjmlzg5mze2nty3mjg2mdyvttmymzyuanbnfdrmnmi2n2njm2vlmwvjmmezyjnhowfiztfiytbmymjmnji1y2ixyta4yjnjownkm2eyogvmownkodc3zjixodm.jpeg)
