[email protected]
CAS 82692-93-1 Sodium 3-[Ethyl(m-tolyl)amino]-2-hydroxy-1-propanesulfonate molecular structure lightbox
CAS RN: 82692-93-1

Sodium 3-[Ethyl(m-tolyl)amino]-2-hydroxy-1-propanesulfonate

Product Availability

Choose a grade to view its available package options.

7 package records7 with current stock3 grade groups
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250209 100g In stock Shenzhen, Tianjin, Wuhan, Chengdu Inquiry
Batchno.20250923 100mg In stock Shanghai Inquiry
Batchno.20250620 1g In stock Shanghai, Shenzhen, Tianjin, Wuhan, Chengdu Inquiry
Batchno.20260617 25g In stock Shanghai, Shenzhen, Tianjin, Wuhan, Chengdu Inquiry
Batchno.20250627 5g In stock Shanghai, Shenzhen, Tianjin, Wuhan, Chengdu Inquiry
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250105 1g / 5g / 25g / 100g Confirm by inquiry Shanghai, Shandong, Guangdong, Chongqing, Hebei Inquiry
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250227 1g In stock Shandong Inquiry
  • Product code: SSC-190740
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, 25g
  • 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 82692-93-1
Pack Size Recorded Purity Available Qty Ship From Inquiry
5g ＞97% 0 Out of Stock Shanghai Inquiry
25g ＞97% 0 Out of Stock Shenzhen Inquiry

82692-93-1 / sodium 3-(N-ethyl-3-methylanilino)-2-hydroxypropane-1-sulfonate

Standard CAS: 82692-93-1 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
82692-93-1
Multi CAS
Yes
Molecular Formula
C12H18NNAO4S
Molecular Weight
295.330000
Exact Mass
295.085424
InChI
InChI=1S/C12H19NO4S.Na/c1-3-13(8-12(14)9-18(15,16)17)11-6-4-5-10(2)7-11;/h4-7,12,14H,3,8-9H2,1-2H3,(H,15,16,17);/q;+1/p-1
InChIKey
IRQRBVOQGUPTLG-UHFFFAOYSA-M

Computed Properties

Structural Parameters

Heavy atom count
19
Aromatic heavy atom count
6
Fraction Csp3
0.5
Rotatable bonds
6
H-bond acceptors
5
H-bond donors
1
Molar refractivity
69.64
TPSA
80.67

LogP / Solubility

WLOGP
-2.27
MLOGP
-1.98
XLogP3
-2.27
Consensus LogP
-2.17
Log S (ESOL)
-0.08
Class (ESOL)
Very soluble
Log S (Ali)
-0.34
Class (Ali)
Very soluble
Log S (SILICOS-IT)
-0.42
Class (SILICOS-IT)
Very 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)
-6.13

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
Yes
Synthetic Accessibility
2

Customers Also Viewed

Get In Touch

Contact Us