[email protected]
CAS 4808-69-9 6-Methylpyridine-3-sulfonic acid molecular structure lightbox
CAS RN: 4808-69-9

6-Methylpyridine-3-sulfonic acid

Product Availability

Choose a grade to view its available package options.

3 package records3 with current stock1 grade group
Batch No.PackageAvailabilityInquiry
Batchno.20250325 1g In stock Inquiry
Batchno.20251207 250mg In stock Inquiry
Batchno.20251128 5g In stock Inquiry
  • Product code: SSC-155047
GET A QUOTE
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: 5g
  • Available purity: ＞97%
  • Inventory rows with stock: 0
  • Bulk packaging: confirmed by inquiry
Request Bulk Quote

Reference Pack Sizes

Reference pack sizes are shown below. Final availability, packaging and delivery schedule are confirmed by inquiry.

Recorded sizes, purity and stock details for CAS 4808-69-9
Pack Size Recorded Purity Available Qty Ship From Inquiry
5g ＞97% 0 Out of Stock Shanghai Inquiry

4808-69-9 / 6-methylpyridine-3-sulfonic acid

Standard CAS: 4808-69-9 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
4808-69-9
Multi CAS
Yes
Molecular Formula
C6H7NO3S
Molecular Weight
173.190000
Exact Mass
173.014664
InChI
InChI=1S/C6H7NO3S/c1-5-2-3-6(4-7-5)11(8,9)10/h2-4H,1H3,(H,8,9,10)
InChIKey
QFPGRDDFLCHSMR-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
11
Aromatic heavy atom count
6
Fraction Csp3
0.17
Rotatable bonds
1
H-bond acceptors
3
H-bond donors
1
Molar refractivity
38.79
TPSA
67.26

LogP / Solubility

WLOGP
0.64
MLOGP
0.56
Consensus LogP
0.4
Log S (ESOL)
-1.65
Class (ESOL)
Soluble
Log S (Ali)
-1.44
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.43
Class (SILICOS-IT)
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)
-3.32

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

Get In Touch

Contact Us