CAS RN: 915107-31-2
6-Chloro-5-methoxy-nicotinic acid methyl ester
- Product code: SSC-204725
Verified Factory Data
Supply Overview & Packaging Options
Packaging options, recorded purity, stock quantity and ship-from location below are generated from the current factory data table for this CAS.
- Pack sizes on record: 1g, 10g, 0.1g, 0.25g, 5g, 25g
- Available purity: >97%
- Inventory rows with stock: 6
- Bulk packaging: confirmed by inquiry
Available Pack Sizes & Stock
Specific stock quantities are shown below. Price is not displayed online and is confirmed by inquiry.
| Pack Size | Recorded Purity | Available Qty | Ship From | Inquiry |
|---|---|---|---|---|
| 1g | >97% | 5 In Stock | Hong Kong | Inquiry |
| 10g | >97% | 4 In Stock | Hong Kong | Inquiry |
| 0.1g | >97% | 3 In Stock | Beijing | Inquiry |
| 0.25g | >97% | 3 In Stock | Beijing | Inquiry |
| 5g | >97% | 2 In Stock | Beijing | Inquiry |
| 25g | >97% | 1 In Stock | Shanghai | Inquiry |
915107-31-2 / methyl 6-chloro-5-methoxypyridine-3-carboxylate
Basic Information
CAS
915107-31-2
Multi CAS
No
Molecular Formula
C8H8CLNO3
Molecular Weight
201.610000
Exact Mass
201.019271
InChI
InChI=1S/C8H8ClNO3/c1-12-6-3-5(8(11)13-2)4-10-7(6)9/h3-4H,1-2H3
InChIKey
XPHMEWSKODAWPT-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
13
Aromatic heavy atom count
6
Fraction Csp3
0.25
Rotatable bonds
2
H-bond acceptors
4
Molar refractivity
47.14
TPSA
48.42
LogP / Solubility
WLOGP
1.53
MLOGP
1.35
XLogP3
1.6
Consensus LogP
1.49
Log S (ESOL)
-2.26
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.32
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.48
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)
-2.86
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
Customers Also Viewed
-
6-chloro-5-methoxy- 3-Pyridinecarboxylic acid
- CAS RN: 915107-39-0
- Product Code: SSC-204726
-
(6-chloro-5-methoxypyridin-3-yl)methanol
- CAS RN: 915107-47-0
- Product Code: starshine_CAS915107-47-0
- Purity/Analytical method: >99.0%
-
-
4-PYRIDINECARBOXYLIC ACID, 2-(HYDROXYMETHYL)-
- CAS RN: 915140-06-6
- Product Code: SSC-204731
-
6-chloro-1H-pyrrolo[2,3-b]pyridine-3-carboxylic acid
- CAS RN: 915140-96-4
- Product Code: SSC-204732
-
![CAS 915140-96-4 6-chloro-1H-pyrrolo[2,3-b]pyridine-3-carboxylic acid molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/915140-96-4.gif)
