pyridoxamine (CAS 85-87-0) — formula C8H12N2O2, molecular weight 168.19; category organic chemicals.
| CAS Number | 85-87-0 |
|---|---|
| Molecular Formula | C8H12N2O2 |
| Molecular Weight | 168.19 |
| LogP | -0.83 |
| Category | Organic Chemicals |
pyridoxamine is a carbon-based organic compound with CAS registry number 85-87-0 and molecular formula C8H12N2O2 (molecular weight 168.19), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 85-87-0
Its molecular formula C8H12N2O2 comprises 8 C, 12 H, 2 N, 2 O atoms.
Also known as: pyridoxamine · 吡哆胺
Category: organic chemicals
The CAS registry number of pyridoxamine is 85-87-0.
Molecular formula C8H12N2O2, molecular weight 168.19.
It is also registered under: pyridoxamine, 吡哆胺.
Category: Organic Chemicals.
Independent reference data for pyridoxamine (CAS 85-87-0), compiled from public chemistry databases.
| CAS Registry Number | 85-87-0 |
|---|---|
| PubChem CID | 1052 |
| Molecular formula | C8H12N2O2 |
| IUPAC name | 4-(aminomethyl)-5-(hydroxymethyl)-2-methylpyridin-3-ol |
| UNII (FDA) | 6466NM3W93 |
| Molecular Weight | 168.19 |
|---|---|
| XLogP3 | -1 |
| Hydrogen Bond Donor Count | 3 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 2 |
| Exact Mass | 168.089877630 |
| Monoisotopic Mass | 168.089877630 |
| Topological Polar Surface Area | 79.4 |
| Heavy Atom Count | 12 |
| Solubility | 815 mg/mL |
|---|---|
| LogP | -0.83 |
| Ionization Efficiency | 2.96 |
| Ionization Efficiency | 2.7 |
| Ionization Efficiency | MeCN (80%) |
| Ionization Efficiency | DOI:10.1038/s41598-020-62573-z |
| Dissociation Constants | 10.34 |
| Collision Cross Section | 136.4 Ų [M-H]- |
| Collision Cross Section | 145.7 Ų [M+Na]+ |
| Collision Cross Section | 134.4 Ų [M+H]+ |
pyridoxamine; 85-87-0; Pyridoxylamine; 4-(AMINOMETHYL)-5-(HYDROXYMETHYL)-2-METHYLPYRIDIN-3-OL; 3-Pyridinemethanol, 4-(aminomethyl)-5-hydroxy-6-methyl-; CHEBI:16410; DTXSID6046929; 6466NM3W93; RefChem:177725; DTXCID4026929; 4-(azaniumylmethyl)-5-(hydroxymethyl)-2-methylpyridin-3-olate; 201-640-5; 4-(Aminomethyl)-5-(hydroxymethyl)-2-methyl-3-pyridinol; EINECS 201-640-5; MFCD00464815; NCIStruc1_000457
pyridoxamine · CAS 85-87-0 · C8H12N2O2. UNII 6466NM3W93. Solubility: 815 mg/mL; LogP: -0.83; Ionization Efficiency: 2.96.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: 吡哆胺