CAS RN: 100047-36-7
4-Aminopyridine-2-carboxylic acid
Product Availability
Choose a grade to view its available package options.
4 package records4 with current stock1 grade group
- Product code: SSC-000194
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, 5g, 10g, 25g, 100g
- Available purity: ≥95%
- Inventory rows with stock: 3
- 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 | ≥95% | 5 In Stock | Shenzhen | Inquiry |
| 5g | ≥95% | 5 In Stock | Hong Kong | Inquiry |
| 10g | ≥95% | 3 In Stock | Hong Kong | Inquiry |
| 25g | ≥95% | 0 Out of Stock | Hong Kong | Inquiry |
| 100g | ≥95% | 0 Out of Stock | Shanghai | Inquiry |
100047-36-7 / 4-aminopyridine-2-carboxylic acid
4-AMINOPYRIDINE-2-CARBOXYLIC ACID | 4-Aminopicolinic acid | 100047-36-7
Basic Information
CAS
100047-36-7
Multi CAS
Yes
Molecular Formula
C6H6N2O2
Molecular Weight
138.120000
Exact Mass
138.042927
SMILES
C1=CN=C(C=C1N)C(=O)O
InChI
InChI=1S/C6H6N2O2/c7-4-1-2-8-5(3-4)6(9)10/h1-3H,(H2,7,8)(H,9,10)
InChIKey
JRZBTJVSAANBEV-UHFFFAOYSA-N
Synonyms
4-AMINOPYRIDINE-2-CARBOXYLIC ACID
4-Aminopicolinic acid
100047-36-7
DTXSID70365991
RefChem:518278
Computed Properties
Structural Parameters
Heavy atom count
10
Aromatic heavy atom count
6
Rotatable bonds
1
H-bond acceptors
3
H-bond donors
2
Molar refractivity
35.61
TPSA
76.21
LogP / Solubility
WLOGP
0.36
MLOGP
0.31
Consensus LogP
0.22
Log S (ESOL)
-1.3
Class (ESOL)
Soluble
Log S (Ali)
-0.95
Class (Ali)
Very soluble
Log S (SILICOS-IT)
-0.98
Class (SILICOS-IT)
Very 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)
-3.31
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
1.5
Safety & Transport
Pictogram(s)
Irritant
Signal
Warning
GHS Hazard Statements
H302 (95.1%): Harmful if swallowed [Warning Acute toxicity, oral]
Precautionary Statement Codes
P264, P270, P301+P317, P330, and P501
Customers Also Viewed
-
![CAS 100047-42-5 6-(Methylthio)-1H-pyrazolo[3,4-d]pyriMidin-3(2H)-one molecular structure](data:image/svg+xml,%3Csvg%20xmlns='http://www.w3.org/2000/svg'%20viewBox='0%200%200%200'%3E%3C/svg%3E)
6-(Methylthio)-1H-pyrazolo[3,4-d]pyriMidin-3(2H)-one
- CAS RN: 100047-42-5
- Product Code: SSC-000196
-
-
-
1-methyl-6-oxo-1,6-dihydropyridazine-3-carboxylic acid
- CAS RN: 100047-66-3
- Product Code: SSC-000201
-
-
![CAS 100047-42-5 6-(Methylthio)-1H-pyrazolo[3,4-d]pyriMidin-3(2H)-one molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/100047-42-5.gif)
.gif)