CAS RN: 1163248-54-1
B-(5-Methyl-1H-Pyrazol-3-Yl)Boronic Acid
Product Availability
Choose a grade to view its available package options.
1 package records1 with current stock1 grade group
| Batch No. | Package | Availability | Warehouse | Inquiry |
|---|---|---|---|---|
| Batchno.20250318 | 100mg / 250mg / 1g / 5g | Confirm by inquiry | Shanghai | Inquiry |
- Product code: SSC-016392
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: 1g, 10g, 0.1g, 0.25g, 5g, 25g
- Available purity: ≥97%
- Inventory rows with stock: 6
- 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 |
|---|---|---|---|---|
| 1g | ≥97% | 4 In Stock | Hong Kong | Inquiry |
| 10g | ≥97% | 3 In Stock | Shanghai | Inquiry |
| 0.1g | ≥97% | 2 In Stock | Shanghai | Inquiry |
| 0.25g | ≥97% | 2 In Stock | Beijing | Inquiry |
| 5g | ≥97% | 2 In Stock | Shenzhen | Inquiry |
| 25g | ≥97% | 1 In Stock | Shanghai | Inquiry |
1163248-54-1 / (3-methyl-1H-pyrazol-5-yl)boronic acid
(5-Methyl-1H-pyrazol-3-yl)boronic acid | (3-methyl-1H-pyrazol-5-yl)boronic acid | B-(5-methyl-1H-pyrazol-3-yl)Boronic acid
Basic Information
CAS
1163248-54-1
Multi CAS
No
Molecular Formula
C4H7BN2O2
Molecular Weight
125.920000
Exact Mass
126.060058
SMILES
B(C1=CC(=NN1)C)(O)O
InChI
InChI=1S/C4H7BN2O2/c1-3-2-4(5(8)9)7-6-3/h2,8-9H,1H3,(H,6,7)
InChIKey
VWENLWUOIPCRRJ-UHFFFAOYSA-N
Synonyms
(5-Methyl-1H-pyrazol-3-yl)boronic acid
(3-methyl-1H-pyrazol-5-yl)boronic acid
B-(5-methyl-1H-pyrazol-3-yl)Boronic acid
Boronic acid, B-(5-methyl-1H-pyrazol-3-yl)-
5-Methylpyrazole-3-boronic Acid
Computed Properties
Structural Parameters
Heavy atom count
9
Aromatic heavy atom count
5
Fraction Csp3
0.25
Rotatable bonds
1
H-bond acceptors
3
H-bond donors
3
Molar refractivity
33.15
TPSA
69.14
LogP / Solubility
WLOGP
-1.6
MLOGP
-1.42
XLogP3
-1.6
Consensus LogP
-1.54
Log S (ESOL)
0.04
Class (ESOL)
Highly soluble
Log S (Ali)
0.56
Class (Ali)
Highly soluble
Log S (SILICOS-IT)
0.73
Class (SILICOS-IT)
Highly soluble
ADME
GI absorption
Low
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-4.63
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
-
(R)-3-EthylaMino-piperidine-1-carboxylic acid tert-butyl ester
- CAS RN: 1163285-65-1
- Product Code: SSC-016396
-
Methyl 4-fluoro-2-methyl-5-nitrobenzoate 98%
- CAS RN: 1163287-01-1
- Product Code: SSC-016398
-
5-Chloro-2-hydroxy-6-methyl-nicotinonitrile
- CAS RN: 1163297-82-2
- Product Code: starshine_CAS1163297-82-2
- Purity/Analytical method: >99.0%
-
-
1-(1H-benzo[d]imidazol-2-yl)-3-methyl-4-oxo-1,4-dihydropyridine-2-carboxylic acid
- CAS RN: 1163685-30-0
- Product Code: starshine_CAS1163685-30-0
- Purity/Analytical method: >99.0%
-
![CAS 1163685-30-0 1-(1H-benzo[d]imidazol-2-yl)-3-methyl-4-oxo-1,4-dihydropyridine-2-carboxylic acid molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/1163685-30-0.gif)
