CAS RN: 1246242-18-1
8-ethylquinoline 1-oxide
Product Availability
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1 package records 1 with current stock 1 grade group
Grade
95% (1)
In stock only
Batch No. Package Availability Warehouse Inquiry
Batchno.20260202
100mg / 250mg / 1g
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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: 1g
Available purity: ≥95%
Inventory rows with stock: 0
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Recorded sizes, purity and stock details for CAS 1246242-18-1
Pack Size
Recorded Purity
Available Qty
Ship From
Inquiry
1g
≥95%
0
Out of Stock
Shenzhen
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1246242-18-1 / 8-ethyl-1-oxidoquinolin-1-ium
Standard CAS: 1246242-18-1
Multi CAS: No
Basic Information
copy
CAS
1246242-18-1 copy
Multi CAS
No copy
Molecular Formula
C11H11NO copy
Molecular Weight
173.210000 copy
Exact Mass
173.084064 copy
SMILES
CCC1=CC=CC2=C1[N+](=CC=C2)[O-] copy
InChI
InChI=1S/C11H11NO/c1-2-9-5-3-6-10-7-4-8-12(13)11(9)10/h3-8H,2H2,1H3 copy
InChIKey
LZEBWZDDNNWJJK-UHFFFAOYSA-N copy
Computed Properties
copy
Structural Parameters
Heavy atom count
13 copy
Aromatic heavy atom count
10 copy
Fraction Csp3
0.18 copy
Rotatable bonds
1 copy
H-bond acceptors
1 copy
Molar refractivity
52.29 copy
TPSA
26.94 copy
LogP / Solubility
WLOGP
2.04 copy
MLOGP
1.79 copy
XLogP3
2 copy
Consensus LogP
1.94 copy
Log S (ESOL)
-2.7 copy
Class (ESOL)
Moderately soluble copy
Log S (Ali)
-2.45 copy
Class (Ali)
Moderately soluble copy
Log S (SILICOS-IT)
-2.6 copy
Class (SILICOS-IT)
Moderately soluble copy
ADME
GI absorption
High copy
BBB permeant
Yes copy
P-gp substrate
No copy
CYP1A2 inhibitor
Yes copy
CYP2C19 inhibitor
No copy
CYP2C9 inhibitor
No copy
CYP2D6 inhibitor
No copy
CYP3A4 inhibitor
No copy
Log Kp (skin permeation)
-2.33 copy
Drug-likeness / Medicinal Chemistry
Lipinski
Yes copy
Ghose
No copy
Veber
Yes copy
Egan
Yes copy
Muegge
No copy
Bioavailability score
0.55 copy
Brenk alerts
1 copy
Leadlikeness
No copy
Synthetic Accessibility
1.5 copy