4-(METHYLNITROSAMINO)-1-(3-PYRIDYL-N-OXIDE)-1-BUTANOL (CAS 85352-99-4) — formula C10H15N3O3, molecular weight 225.24; category organic chemicals.
| CAS Number | 85352-99-4 |
|---|---|
| Molecular Formula | C10H15N3O3 |
| Molecular Weight | 225.24 |
| LogP | -0.3 |
| Category | Organic Chemicals |
4-(METHYLNITROSAMINO)-1-(3-PYRIDYL-N-OXIDE)-1-BUTANOL is a carbon-based organic compound with CAS registry number 85352-99-4 and molecular formula C10H15N3O3 (molecular weight 225.24), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 85352-99-4
Its molecular formula C10H15N3O3 comprises 10 C, 15 H, 3 N, 3 O atoms.
Also known as: 4-(METHYLNITROSAMINO)-1-(3-PYRIDYL-N-OXIDE)-1-BUTANOL · 4-(甲基亚硝氨基)-1-(3-吡啶基-N-氧化物)-1-丁醇
Category: organic chemicals
The CAS registry number of 4-(METHYLNITROSAMINO)-1-(3-PYRIDYL-N-OXIDE)-1-BUTANOL is 85352-99-4.
Molecular formula C10H15N3O3, molecular weight 225.24.
It is also registered under: 4-(METHYLNITROSAMINO)-1-(3-PYRIDYL-N-OXIDE)-1-BUTANOL, 4-(甲基亚硝氨基)-1-(3-吡啶基-N-氧化物)-1-丁醇.
Category: Organic Chemicals.
Independent reference data for 4-(METHYLNITROSAMINO)-1-(3-PYRIDYL-N-OXIDE)-1-BUTANOL (CAS 85352-99-4), compiled from public chemistry databases.
| CAS 号 | 85352-99-4 |
|---|---|
| PubChem CID | 150097 |
| 分子式 | C10H15N3O3 |
| IUPAC 名称 | N-[4-hydroxy-4-(1-oxidopyridin-1-ium-3-yl)butyl]-N-methylnitrous amide |
| UNII（FDA） | XE22YS2NLF |
| Molecular Weight | 225.24 |
|---|---|
| XLogP3 | -0.3 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 5 |
| Exact Mass | 225.11134135 |
| Monoisotopic Mass | 225.11134135 |
| Topological Polar Surface Area | 78.4 |
| Heavy Atom Count | 16 |
NNAL-N-oxide; 85352-99-4; 4-(Methylnitrosamino)-1-(3-pyridyl-N-oxide)-1-butanol; XE22YS2NLF; 3-Pyridinemethanol, alpha-(3-(methylnitrosoamino)propyl)-, 1-oxide; 3-(1-hydroxy-4-(methyl(nitroso)amino)butyl)-1$l^(5)-pyridin-1-one; 3-{1-hydroxy-4-[methyl(nitroso)amino]butyl}-1$l^{5}-pyridin-1-one; RefChem:1070155; N-[4-hydroxy-4-(1-oxidopyridin-1-ium-3-yl)butyl]-N-methylnitrous amide; UNII-XE22YS2NLF; N-Nitroso-Cotinine Impurity 4; SCHEMBL3930852; CHEBI:82589; AKOS030255798; NS00115036; C19603
4-(甲基亚硝氨基)-1-(3-吡啶基-N-氧化物)-1-丁醇 · CAS 85352-99-4 · C10H15N3O3. UNII XE22YS2NLF.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.