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CAS 116529-84-1 6-Methylquinolin-5-ol molecular structure lightbox
CAS RN: 116529-84-1

6-Methylquinolin-5-ol

Product Availability

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1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20250508 100mg / 250mg Out of stock 5-7 business days Inquiry
  • Product code: SSC-016512
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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 116529-84-1
Pack Size Recorded Purity Available Qty Ship From Inquiry
0.1g ≥95% 0 Out of Stock Shenzhen Inquiry

116529-84-1 / 6-methylquinolin-5-ol

6-Methylquinolin-5-ol | 5-Quinolinol, 6-methyl- | MFCD18414794

Standard CAS: 116529-84-1 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
116529-84-1
Multi CAS
No
Molecular Formula
C10H9NO
Molecular Weight
159.180000
Exact Mass
159.068414
SMILES
CC1=C(C2=C(C=C1)N=CC=C2)O
InChI
InChI=1S/C10H9NO/c1-7-4-5-9-8(10(7)12)3-2-6-11-9/h2-6,12H,1H3
InChIKey
ZWMNWHYDZZZKPK-UHFFFAOYSA-N
Synonyms
6-Methylquinolin-5-ol 5-Quinolinol, 6-methyl- MFCD18414794 6-methyl-5-Quinolinol SCHEMBL5541888

Computed Properties

Structural Parameters

Heavy atom count
12
Aromatic heavy atom count
10
Fraction Csp3
0.1
H-bond acceptors
2
H-bond donors
1
Molar refractivity
48.14
TPSA
33.12

LogP / Solubility

WLOGP
2.25
MLOGP
1.97
XLogP3
2.6
Consensus LogP
2.27
Log S (ESOL)
-2.86
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.49
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.56
Class (SILICOS-IT)
Moderately soluble

ADME

GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2.09

Drug-likeness / Medicinal Chemistry

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

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