[email protected]
CAS 52126-51-9 3-Carboxy-1-(4-sulfophenyl)-5-pyrazolone Sodium Salt molecular structure lightbox
CAS RN: 52126-51-9

3-Carboxy-1-(4-sulfophenyl)-5-pyrazolone Sodium Salt

Product Availability

Choose a grade to view its available package options.

5 package records4 with current stock2 grade groups
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250514 5g / 25g / 100g Confirm by inquiry Shanghai Inquiry
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250225 100g Out of stock Inquiry
Batchno.20250817 1g In stock Shanghai Inquiry
Batchno.20260417 25g In stock Shanghai, Tianjin, Wuhan, Chengdu Inquiry
Batchno.20260627 5g In stock Shanghai, Wuhan Inquiry
  • Product code: SSC-159216
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: ≥95%
  • 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 52126-51-9
Pack Size Recorded Purity Available Qty Ship From Inquiry
5g ≥95% 0 Out of Stock Beijing Inquiry

52126-51-9 / sodium 4-(5-carboxy-3-oxo-1H-pyrazol-2-yl)benzenesulfonate

Standard CAS: 52126-51-9 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
52126-51-9
Multi CAS
Yes
Molecular Formula
C10H7N2NAO6S
Molecular Weight
306.230000
Exact Mass
305.992251
InChI
InChI=1S/C10H8N2O6S.Na/c13-9-5-8(10(14)15)11-12(9)6-1-3-7(4-2-6)19(16,17)18;/h1-5,11H,(H,14,15)(H,16,17,18);/q;+1/p-1
InChIKey
ZBWNDDPCZBRNEC-UHFFFAOYSA-M

Computed Properties

Structural Parameters

Heavy atom count
20
Aromatic heavy atom count
11
Rotatable bonds
3
H-bond acceptors
6
H-bond donors
2
Molar refractivity
61.31
TPSA
132.29

LogP / Solubility

WLOGP
-3.23
MLOGP
-2.83
XLogP3
-3.23
Consensus LogP
-3.1
Log S (ESOL)
0.09
Class (ESOL)
Highly soluble
Log S (Ali)
0.26
Class (Ali)
Highly soluble
Log S (SILICOS-IT)
0.67
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)
-6.88

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
No
Muegge
No
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
Yes
Synthetic Accessibility
1.5

Customers Also Viewed

Get In Touch

Contact Us