-
Name
(2S,3S,4R,5R)-N-ethyl-3,4-dihydroxy-5-(1-hydroxy-6-imino-purin-9-yl)ox olane-2-carboxamide
- EINECS
- CAS No. 72209-27-9
- Density 1.93g/cm3
- Solubility
- Melting Point
- Formula C12H16N6O5
- Boiling Point 462.64°C (rough estimate)
- Molecular Weight 324.296
- Flash Point
- Transport Information
- Appearance
- Safety Poison by ingestion and intraperitoneal routes. When heated to decomposition it emits toxic fumes of NOx.
- Risk Codes
-
Molecular Structure
- Hazard Symbols
- Synonyms (2S,3S,4R,5R)-N-ethyl-3,4-dihydroxy-5-(1-hydroxy-6-imino-purin-9-yl)ox olane-2-carboxamide
- PSA 162.00000
- LogP -1.35510
Adenosine-5'-(N-ethyl)carboxamide N'-oxide Chemical Properties
The Molecular Structure of Adenosine-5'-(N-ethyl)carboxamide N'-oxide (CAS NO.72209-27-9):
Molecular Formula: C12H16N6O5
Nominal Mass: 324 Da
Average Mass: 324.2926 Da
Monoisotopic Mass: 324.118218 Da
Index of Refraction: 1.833
Molar Refractivity: 73.8 cm3
Molar Volume: 167.5 cm3
Surface Tension: 94.4 dyne/cm
Density: 1.93 g/cm3
Classification Code: Drug / Therapeutic Agent
Smiles: O[C@H]1[C@@H](O[C@@H]([C@H]1O)C(=O)NCC)n1cnc2c(n(cnc12)=O)N
Adenosine-5'-(N-ethyl)carboxamide N'-oxide Toxicity Data With Reference
| 1. | orl-mus LD50:20 mg/kg | JMCMAR Journal of Medicinal Chemistry. 23 (1980),313. | ||
| 2. | ipr-mus LD50:2 mg/kg | JMCMAR Journal of Medicinal Chemistry. 23 (1980),313. |
Adenosine-5'-(N-ethyl)carboxamide N'-oxide Safety Profile
Poison by ingestion and intraperitoneal routes. When heated to decomposition it emits toxic fumes of NOx.
Adenosine-5'-(N-ethyl)carboxamide N'-oxide Specification
Adenosine-5'-(N-ethyl)carboxamide N'-oxide (CAS NO.72209-27-9) is also called as 1-(6-Amino-9H-purin-9-yl)-1-deoxy-N-ethylribofuranuronamide N-oxide ; Ribofuranuronamide, 1-(6-amino-9H-purin-9-yl)-1-deoxy-N-ethyl-, N-oxide .
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