CAS RN: 436853-63-3
3,5-dimethylphenylboronic acid-1,3-propanediol ester
Product Availability
Choose a grade to view its available package options.
4 package records2 with current stock1 grade group
| Batch No. | Package | Availability | Warehouse | Lead Time | Inquiry |
|---|---|---|---|---|---|
| Batchno.20250413 | 1g | In stock | Shanghai, Tianjin, Wuhan | Inquiry | |
| Batchno.20251228 | 250mg | In stock | Shanghai, Shenzhen, Tianjin, Wuhan | Inquiry | |
| Batchno.20250630 | 250mg / 1g / 5g | Out of stock | 8-10 business days | Inquiry | |
| Batchno.20250525 | 5g | Out of stock | Inquiry |
- Product code: starshine_CAS436853-63-3
- Purity/Analytical Methods: >99.0%
436853-63-3 / 2-(3,5-dimethylphenyl)-1,3,2-dioxaborinane
Basic Information
CAS
436853-63-3
Multi CAS
Yes
Molecular Formula
BC11H15O2
Molecular Weight
190.050000
Exact Mass
190.116510
InChI
InChI=1S/C11H15BO2/c1-9-6-10(2)8-11(7-9)12-13-4-3-5-14-12/h6-8H,3-5H2,1-2H3
InChIKey
BBDURTGMHLDAQY-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
14
Aromatic heavy atom count
6
Fraction Csp3
0.45
Rotatable bonds
1
H-bond acceptors
2
Molar refractivity
57.83
TPSA
18.46
LogP / Solubility
WLOGP
1.44
MLOGP
1.26
XLogP3
1.44
Consensus LogP
1.38
Log S (ESOL)
-2.17
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.15
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.21
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)
-2.86
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 436863-50-2 1,1Bis[(2S,5S)-2,5-diethylphospholano]ferrocene, min. 97% molecular structure](data:image/svg+xml,%3Csvg%20xmlns='http://www.w3.org/2000/svg'%20viewBox='0%200%200%200'%3E%3C/svg%3E)
1,1Bis[(2S,5S)-2,5-diethylphospholano]ferrocene, min. 97%
- CAS RN: 436863-50-2
- Product Code: SSC-151794
-
3-(TERT-BUTOXYCARBONYLAMINO)PIPERIDINE-3-CARBOXYLIC ACID
- CAS RN: 436867-71-9
- Product Code: SSC-151795
-
-
Ethanone, 1-(1,3-benzodioxol-5-yl)-2,2-difluoro- (9CI)
- CAS RN: 437552-71-1
- Product Code: SSC-151825
-
-
3”,4”-Di-O-p-coumaroylquercitrin
- CAS RN: 437615-43-5
- Product Code: starshine_CAS437615-43-5
- Purity/Analytical method: >99.0%
![CAS 436863-50-2 1,1Bis[(2S,5S)-2,5-diethylphospholano]ferrocene, min. 97% molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/436863-50-2.gif)
