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CAS 852127-05-0 S-1,1′-binaphthalene-2,2′-disulfonic acid molecular structure lightbox
CAS RN: 852127-05-0

S-1,1′-binaphthalene-2,2′-disulfonic acid

Product Availability

Choose a grade to view its available package options.

5 package records3 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20260309 100mg In stock Shanghai, Tianjin, Chengdu Inquiry
Batchno.20250708 100mg / 250mg / 1g Out of stock 8-10 business days Inquiry
Batchno.20260310 1g In stock Shanghai Inquiry
Batchno.20250120 250mg In stock Shanghai, Shenzhen Inquiry
Batchno.20250723 5g Out of stock Inquiry
  • Product code: SSC-193455
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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: 0.1g
  • Available purity: ≥95%
  • Inventory rows with stock: 0
  • Bulk packaging: confirmed by inquiry
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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 852127-05-0
Pack Size Recorded Purity Available Qty Ship From Inquiry
0.1g ≥95% 0 Out of Stock Beijing Inquiry

852127-05-0 / 1-(2-sulfonaphthalen-1-yl)naphthalene-2-sulfonic acid

Standard CAS: 852127-05-0 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
852127-05-0
Multi CAS
No
Molecular Formula
C20H14O6S2
Molecular Weight
414.500000
Exact Mass
414.023181
InChI
InChI=1S/C20H14O6S2/c21-27(22,23)17-11-9-13-5-1-3-7-15(13)19(17)20-16-8-4-2-6-14(16)10-12-18(20)28(24,25)26/h1-12H,(H,21,22,23)(H,24,25,26)
InChIKey
ZSWODTYSMOCDKE-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
28
Aromatic heavy atom count
20
Rotatable bonds
3
H-bond acceptors
4
H-bond donors
2
Molar refractivity
106.52
TPSA
108.74

LogP / Solubility

WLOGP
4.15
MLOGP
3.68
XLogP3
3.5
Consensus LogP
3.78
Log S (ESOL)
-5.36
Class (ESOL)
Slightly soluble
Log S (Ali)
-5.96
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-6.16
Class (SILICOS-IT)
Insoluble

ADME

GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-2.3

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
3

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