![CAS 1188539-34-5 6-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)-furo[3,2-b]pyridine molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/1188539-34-5.gif)
CAS RN: 1188539-34-5
6-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)-furo[3,2-b]pyridine
Product Availability
Choose a grade to view its available package options.
1 package records0 with current stock1 grade group
| Batch No. | Package | Availability | Lead Time | Inquiry |
|---|---|---|---|---|
| Batchno.20250714 | 100mg / 500mg | Out of stock | 8-10 business days | Inquiry |
- Product code: SSC-019087
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: 0.25g
- 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 |
|---|---|---|---|---|
| 0.25g | ≥95% | 0 Out of Stock | Hong Kong | Inquiry |
1188539-34-5 / 6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)furo[3,2-b]pyridine
6-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)furo[3,2-b]pyridine | DTXSID30673943 | 6-(4,4,5,5-Tetramethyl-1,3,2-Dioxaborolan-2-Yl)Furo(3,2-B)Pyridine
Basic Information
CAS
1188539-34-5
Multi CAS
No
Molecular Formula
C13H16BNO3
Molecular Weight
245.080000
Exact Mass
245.122324
SMILES
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=CO3)N=C2
InChI
InChI=1S/C13H16BNO3/c1-12(2)13(3,4)18-14(17-12)9-7-11-10(15-8-9)5-6-16-11/h5-8H,1-4H3
InChIKey
GSSJAXUDJLCMNO-UHFFFAOYSA-N
Synonyms
6-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)furo[3,2-b]pyridine
DTXSID30673943
6-(4,4,5,5-Tetramethyl-1,3,2-Dioxaborolan-2-Yl)Furo(3,2-B)Pyridine
RefChem:539335
DTXCID30624692
Computed Properties
Structural Parameters
Heavy atom count
18
Aromatic heavy atom count
9
Fraction Csp3
0.46
Rotatable bonds
1
H-bond acceptors
4
Molar refractivity
69.73
TPSA
44.49
LogP / Solubility
WLOGP
2.13
MLOGP
1.88
XLogP3
2.13
Consensus LogP
2.05
Log S (ESOL)
-3
Class (ESOL)
Poorly soluble
Log S (Ali)
-3.11
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.14
Class (SILICOS-IT)
Poorly soluble
ADME
GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2.7
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
Safety & Transport
Pictogram(s)
Acute Toxic
Signal
Danger
GHS Hazard Statements
H301 (100%): Toxic if swallowed [Danger Acute toxicity, oral]
H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]
Precautionary Statement Codes
P264, P264+P265, P270, P280, P301+P316, P305+P351+P338, P321, P330, P337+P317, P405, and P501
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