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CAS 207386-92-3 8-HYDROXYQUINOLINE-5-SULFONIC ACID molecular structure lightbox
CAS RN: 207386-92-3

8-HYDROXYQUINOLINE-5-SULFONIC ACID

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6 package records5 with current stock2 grade groups
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250425 100g In stock Inquiry
Batchno.20260616 25g In stock Inquiry
Batchno.20250903 500g Out of stock Inquiry
Batchno.20250522 5g In stock Inquiry
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250908 25g In stock Shanghai, Shandong, Chongqing Inquiry
Batchno.20260216 5g In stock Shanghai, Guangdong Inquiry
  • Product code: starshine_CAS207386-92-3
  • Purity/Analytical Methods: >99.0%
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207386-92-3 / 8-hydroxyquinoline-5-sulfonic acid;hydrate

Standard CAS: 207386-92-3 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
207386-92-3
Multi CAS
No
Molecular Formula
C9H9NO5S
Molecular Weight
243.240000
Exact Mass
243.020144
SMILES
C1=CC2=C(C=CC(=C2N=C1)O)S(=O)(=O)O.O
InChI
InChI=1S/C9H7NO4S.H2O/c11-7-3-4-8(15(12,13)14)6-2-1-5-10-9(6)7;/h1-5,11H,(H,12,13,14);1H2
InChIKey
WUXYGIQVWKDVTJ-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
16
Aromatic heavy atom count
10
Rotatable bonds
1
H-bond acceptors
4
H-bond donors
2
Molar refractivity
56.84
TPSA
118.99

LogP / Solubility

WLOGP
0.36
MLOGP
0.32
XLogP3
0.36
Consensus LogP
0.35
Log S (ESOL)
-1.97
Class (ESOL)
Soluble
Log S (Ali)
-1.82
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.66
Class (SILICOS-IT)
Soluble

ADME

GI absorption
High
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)
-3.95

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

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