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CAS 1088496-41-6 6-(methylsulfonyl)pyridine-3-boronic acid molecular structure lightbox
CAS RN: 1088496-41-6

6-(methylsulfonyl)pyridine-3-boronic acid

Product Availability

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5 package records1 with current stock2 grade groups
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20251201 100mg / 250mg / 1g / 5g Out of stock 5-7 business days Inquiry
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20250624 100mg Out of stock Inquiry
Batchno.20260430 1g Out of stock Inquiry
Batchno.20250325 250mg Out of stock Inquiry
Batchno.20250117 5g In stock Tianjin Inquiry
  • Product code: SSC-010074
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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, 0.1g, 0.25g, 5g
  • Available purity: ≥98%
  • Inventory rows with stock: 3
  • Bulk packaging: confirmed by inquiry
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Available Pack Sizes & Stock

Specific stock quantities are shown below. Price is not displayed online and is confirmed by inquiry.

Recorded sizes, purity and stock details for CAS 1088496-41-6
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ≥98% 3 In Stock Shenzhen Inquiry
0.1g ≥98% 2 In Stock Beijing Inquiry
0.25g ≥98% 1 In Stock Beijing Inquiry
5g ≥98% 0 Out of Stock Hong Kong Inquiry

1088496-41-6 / (6-methylsulfonyl-3-pyridinyl)boronic acid

2-(METHYLSULFONYL)PYRIDINE-5-BORONIC ACID | RefChem:461406 | 801-109-3

Standard CAS: 1088496-41-6 Multi CAS: No
Basic Information Computed Properties Safety & Transport

Basic Information

CAS
1088496-41-6
Multi CAS
No
Molecular Formula
C6H8BNO4S
Molecular Weight
201.010000
Exact Mass
201.026709
SMILES
B(C1=CN=C(C=C1)S(=O)(=O)C)(O)O
InChI
InChI=1S/C6H8BNO4S/c1-13(11,12)6-3-2-5(4-8-6)7(9)10/h2-4,9-10H,1H3
InChIKey
OBWIRUCBMIYFBP-UHFFFAOYSA-N
Synonyms
2-(METHYLSULFONYL)PYRIDINE-5-BORONIC ACID RefChem:461406 801-109-3 (6-(Methylsulfonyl)pyridin-3-yl)boronic acid 6-(METHYLSULFONYL)PYRIDINE-3-BORONIC ACID

Computed Properties

Structural Parameters

Heavy atom count
13
Aromatic heavy atom count
6
Fraction Csp3
0.17
Rotatable bonds
2
H-bond acceptors
5
H-bond donors
2
Molar refractivity
47.17
TPSA
87.49

LogP / Solubility

WLOGP
-1.84
MLOGP
-1.61
XLogP3
-1.84
Consensus LogP
-1.76
Log S (ESOL)
-0.14
Class (ESOL)
Very soluble
Log S (Ali)
0.12
Class (Ali)
Highly soluble
Log S (SILICOS-IT)
0.32
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)
-5.25

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)
Irritant
Signal
Warning
GHS Hazard Statements
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation] H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]
Precautionary Statement Codes
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501

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