CAS RN: 1196146-98-1
6-Chloro-2-methoxypyridin-3-ol
Product Availability
Choose a grade to view its available package options.
1 package records0 with current stock1 grade group
| Batch No. | Package | Availability | Lead Time | Inquiry |
|---|---|---|---|---|
| Batchno.20250909 | 100mg / 250mg / 1g | Out of stock | 8-10 business days | Inquiry |
- Product code: starshine_CAS1196146-98-1
- Purity/Analytical Methods: >99.0%
1196146-98-1 / 6-chloro-2-methoxypyridin-3-ol
6-CHLORO-2-METHOXYPYRIDIN-3-OL | 3-Pyridinol, 6-chloro-2-methoxy- | MFCD13189892
Basic Information
CAS
1196146-98-1
Multi CAS
No
Molecular Formula
C6H6ClNO2
Molecular Weight
159.570000
Exact Mass
159.008706
SMILES
COC1=C(C=CC(=N1)Cl)O
InChI
InChI=1S/C6H6ClNO2/c1-10-6-4(9)2-3-5(7)8-6/h2-3,9H,1H3
InChIKey
UREBWPGQRNTHMW-UHFFFAOYSA-N
Synonyms
6-CHLORO-2-METHOXYPYRIDIN-3-OL
3-Pyridinol, 6-chloro-2-methoxy-
MFCD13189892
6-Chloro-2-methoxy-3-pyridinol
6-Chloro-2-methoxy-pyridin-3-ol
Computed Properties
Structural Parameters
Heavy atom count
10
Aromatic heavy atom count
6
Fraction Csp3
0.17
Rotatable bonds
1
H-bond acceptors
3
H-bond donors
1
Molar refractivity
37.46
TPSA
42.35
LogP / Solubility
WLOGP
1.45
MLOGP
1.27
XLogP3
1.8
Consensus LogP
1.51
Log S (ESOL)
-2.12
Class (ESOL)
Moderately soluble
Log S (Ali)
-1.91
Class (Ali)
Soluble
Log S (SILICOS-IT)
-2.02
Class (SILICOS-IT)
Moderately soluble
ADME
GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2.66
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
1.5
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