CAS RN: 331958-88-4
TETRAHYDROFURAN-2-BORONIC ACID PINACOL ESTER
- Product code: SSC-139141
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: 0.25g, 5g, 1g, 10g, 0.1g
- Available purity: >95%
- Inventory rows with stock: 8
- 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 |
|---|---|---|---|---|
| 0.25g | -- | 3 In Stock | Shenzhen | Inquiry |
| 0.25g | >95% | 3 In Stock | Beijing | Inquiry |
| 5g | -- | 3 In Stock | Hong Kong | Inquiry |
| 5g | >95% | 3 In Stock | Hong Kong | Inquiry |
| 1g | -- | 1 In Stock | Hong Kong | Inquiry |
| 1g | >95% | 1 In Stock | Beijing | Inquiry |
| 10g | -- | 1 In Stock | Hong Kong | Inquiry |
| 10g | >95% | 1 In Stock | Shanghai | Inquiry |
| 0.1g | -- | 0 Out of Stock | Hong Kong | Inquiry |
| 0.1g | >95% | 0 Out of Stock | Shenzhen | Inquiry |
331958-88-4 / 4,4,5,5-tetramethyl-2-(oxolan-2-yl)-1,3,2-dioxaborolane
Basic Information
CAS
331958-88-4
Multi CAS
No
Molecular Formula
BC10H19O3
Molecular Weight
198.070000
Exact Mass
198.142725
InChI
InChI=1S/C10H19BO3/c1-9(2)10(3,4)14-11(13-9)8-6-5-7-12-8/h8H,5-7H2,1-4H3
InChIKey
NRIHVWDOPTVSAN-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
14
Fraction Csp3
1
Rotatable bonds
1
H-bond acceptors
3
Molar refractivity
55.06
TPSA
27.69
LogP / Solubility
WLOGP
1.8
MLOGP
1.58
XLogP3
1.8
Consensus LogP
1.73
Log S (ESOL)
-2.13
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.48
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.56
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)
-2.65
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
2
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