CAS RN: 346656-34-6
Ethyl 2-(5,5-Dimethyl-1,3,2-dioxaborinan-2-yl)benzoate
Product Availability
Choose a grade to view its available package options.
8 package records8 with current stock3 grade groups
| Batch No. | Package | Availability | Warehouse | Inquiry |
|---|---|---|---|---|
| Batchno.20250418 | 250mg / 1g / 5g | Confirm by inquiry | Shanghai, Shandong | Inquiry |
- Product code: SSC-141228
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
- Available purity: ≥95%
- 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 |
|---|---|---|---|---|
| 1g | ≥95% | 0 Out of Stock | Hong Kong | Inquiry |
346656-34-6 / ethyl 2-(5,5-dimethyl-1,3,2-dioxaborinan-2-yl)benzoate
Basic Information
CAS
346656-34-6
Multi CAS
No
Molecular Formula
BC14H19O4
Molecular Weight
262.110000
Exact Mass
262.137639
InChI
InChI=1S/C14H19BO4/c1-4-17-13(16)11-7-5-6-8-12(11)15-18-9-14(2,3)10-19-15/h5-8H,4,9-10H2,1-3H3
InChIKey
GZHASWCTAWNFFW-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
19
Aromatic heavy atom count
6
Fraction Csp3
0.5
Rotatable bonds
3
H-bond acceptors
4
Molar refractivity
73.47
TPSA
44.76
LogP / Solubility
WLOGP
1.63
MLOGP
1.44
XLogP3
1.63
Consensus LogP
1.57
Log S (ESOL)
-2.53
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.89
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-3.08
Class (SILICOS-IT)
Poorly 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)
-3.16
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
Yes
Synthetic Accessibility
1.5
Customers Also Viewed
-
2-(2-Cyanophenyl)-5,5-dimethyl-1,3,2-dioxaborinane
- CAS RN: 214360-47-1
- Product Code: SSC-102771
-
9-([1,1′-Biphenyl]-3-yl)-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-9H-carbazole
- CAS RN: 1533406-38-0
- Product Code: SSC-062818
-
4′-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)acetanilide
- CAS RN: 214360-60-8
- Product Code: SSC-102777
-
2-(2-Bromophenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
- CAS RN: 269410-06-2
- Product Code: SSC-125397
-
2-(3-Buten-1-yl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane (stabilized with Phenothiazine)
- CAS RN: 331958-92-0
- Product Code: SSC-139143
-
2-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)aniline
- CAS RN: 191171-55-8
- Product Code: SSC-089584
![CAS 1533406-38-0 9-([1,1′-Biphenyl]-3-yl)-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-9H-carbazole molecular structure](https://starshinechemical.com/wp-content/uploads/2022/03/b5054-jpgcontextbwfzdgvyfhjvb3r8nda0odr8aw1hz2uvanblz3xom2evagy4lzg5mjkxntazmdqyodyvqjuwntquanbnfgrmmdiznzczywrkyjqwzmmzmzrizwm0ntzhmja5mdfmzgjjzdzmzti3m2iwztrintrlnwe0yte3mtflntayn2i.jpeg)
