ethyl N-[1-oxo-5-(1H-purin-6-ylthio)pentyl]glycinate (CAS 22181-94-8) — formula C14H19N5O3S, molecular weight 337.40; category organic chemicals.
| CAS Number | 22181-94-8 |
|---|---|
| Molecular Formula | C14H19N5O3S |
| Molecular Weight | 337.40 |
| LogP | 0.91 |
| Applications | Chelated mineral salt for food and nutrition |
| Category | Organic Chemicals |
Documented applications: Chelated mineral salt for food and nutrition.
ethyl N-[1-oxo-5-(1H-purin-6-ylthio)pentyl]glycinate is a carbon-based organic compound with CAS registry number 22181-94-8 and molecular formula C14H19N5O3S (molecular weight 337.40), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 22181-94-8
Its molecular formula C14H19N5O3S comprises 14 C, 19 H, 5 N, 3 O, 1 S atoms.
Also known as: ethyl N-[1-oxo-5-(1H-purin-6-ylthio)pentyl]glycinate · (5-((7H-嘌呤-6-基)硫基)戊酰基)甘氨酸乙酯
Category: organic chemicals
The CAS registry number of ethyl N-[1-oxo-5-(1H-purin-6-ylthio)pentyl]glycinate is 22181-94-8.
Molecular formula C14H19N5O3S, molecular weight 337.40.
It is also registered under: ethyl N-[1-oxo-5-(1H-purin-6-ylthio)pentyl]glycinate, (5-((7H-嘌呤-6-基)硫基)戊酰基)甘氨酸乙酯.
Recorded applications: Chelated mineral salt for food and nutrition.
Category: Organic Chemicals.
Independent reference data for ethyl N-[1-oxo-5-(1H-purin-6-ylthio)pentyl]glycinate (CAS 22181-94-8), compiled from public chemistry databases.
| CAS 号 | 22181-94-8 |
|---|---|
| PubChem CID | 89617 |
| 分子式 | C14H19N5O3S |
| IUPAC 名称 | ethyl 2-[5-(7H-purin-6-ylsulfanyl)pentanoylamino]acetate |
| UNII（FDA） | 523O15TF2E |
| Molecular Weight | 337.40 |
|---|---|
| XLogP3 | 0.9 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 7 |
| Rotatable Bond Count | 10 |
| Exact Mass | 337.12086066 |
| Monoisotopic Mass | 337.12086066 |
| Topological Polar Surface Area | 135 |
| Heavy Atom Count | 23 |
| LogP | 0.91 |
|---|
Butocin; 22181-94-8; Butocine; 523O15TF2E; NSC172755; butoglycine; benin spofa; RefChem:926592; N-(5-(6-purinylthio)valeryl)glycine ethyl ester; N-(1-Oxo-5-(9H-purin-6-ylthio)pentyl)glycine ethyl ester; 244-821-4; Benin; ethyl 2-[5-(7H-purin-6-ylsulfanyl)pentanoylamino]acetate; NSC-172755; Ethyl N-[1-oxo-5-(1H-purin-6-ylthio)pentyl]glycinate; Glycine, N-[5-(purin-6-ylthio)valeryl]-, ethyl ester
(5-((7H-嘌呤-6-基)硫基)戊酰基)甘氨酸乙酯 · CAS 22181-94-8 · C14H19N5O3S. UNII 523O15TF2E. LogP: 0.91.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.