N-[1-(S)-Ethoxycarbonyl-3-phenylpropyl]-L-alanine (CAS 82717-96-2) — formula C15H21NO4, molecular weight 279.33; category organic chemicals.
| CAS Number | 82717-96-2 |
|---|---|
| Molecular Formula | C15H21NO4 |
| Molecular Weight | 279.33 |
| LogP | 0.1 |
| Category | Organic Chemicals |
N-[1-(S)-Ethoxycarbonyl-3-phenylpropyl]-L-alanine is a carbon-based organic compound with CAS registry number 82717-96-2 and molecular formula C15H21NO4 (molecular weight 279.33), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 82717-96-2
Its molecular formula C15H21NO4 comprises 15 C, 21 H, 1 N, 4 O atoms.
Also known as: N-[1-(S)-Ethoxycarbonyl-3-phenylpropyl]-L-alanine · N-[1-(S)-乙氧基羰基-3-苯基丙基]-L-丙氨酸
Category: organic chemicals
The CAS registry number of N-[1-(S)-Ethoxycarbonyl-3-phenylpropyl]-L-alanine is 82717-96-2.
Molecular formula C15H21NO4, molecular weight 279.33.
It is also registered under: N-[1-(S)-Ethoxycarbonyl-3-phenylpropyl]-L-alanine, N-[1-(S)-乙氧基羰基-3-苯基丙基]-L-丙氨酸.
Category: Organic Chemicals.
Independent reference data for N-[1-(S)-Ethoxycarbonyl-3-phenylpropyl]-L-alanine (CAS 82717-96-2), compiled from public chemistry databases.
| CAS Registry Number | 82717-96-2 |
|---|---|
| PubChem CID | 5702571 |
| Molecular formula | C15H21NO4 |
| IUPAC name | (2S)-2-[[(2S)-1-ethoxy-1-oxo-4-phenylbutan-2-yl]amino]propanoic acid |
| UNII (FDA) | 10SZ4IJ77B |
| Molecular Weight | 279.33 |
|---|---|
| XLogP3 | 0.1 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 9 |
| Exact Mass | 279.14705815 |
| Monoisotopic Mass | 279.14705815 |
| Topological Polar Surface Area | 75.6 |
| Heavy Atom Count | 20 |
82717-96-2; N-[(S)-1-Ethoxycarbonyl-3-phenylpropyl]-L-alanine; N-(1(S)-ethoxycarbonyl-3-phenylpropyl)-L-alanine; UNII-10SZ4IJ77B; 10SZ4IJ77B; N-[1(S)-ethoxycarbonyl-3-phenylpropyl]-L-alanine; RAMIPRIL IMPURITY F [EP IMPURITY]; (2S)-2-(((1S)-1-(Ethoxycarbonyl)-3-phenylpropyl)amino)propanoic acid; Benzenebutanoic acid, alpha-((1-carboxyethyl)amino)-, monoethyl ester, (S-(theta,theta))-; ENALAPRIL MALEATE IMPURITY B [EP IMPURITY]; ENALAPRILAT DIHYDRATE IMPURITY F [EP IMPURITY]; QUINAPRIL HYDROCHLORIDE IMPURITY B [EP IMPURITY]; N-((S)-1-ETHOXYCARBONYL-3-PHENYLPROPYL)-L-ALANINE; SPIRAPRIL HYDROCHLORIDE MONOHYDRATE IMPURITY C [EP IMPURITY]; (2S)-2-{[(1S)-1-(ethoxycarbonyl)-3-phenylpropyl]amino}propanoic acid; BENZENEBUTANOIC ACID, .ALPHA.-(((1S)-1-CARBOXYETHYL)AMINO)-, 1-ETHYL ESTER, (.ALPHA.S)-
| GHS notification summary | 44.8% (39 / 87) |
|---|
| GHS notification summary | 44.8% (39 / 87) |
|---|---|
| Reported hazard statements | H315 (54%), H319 (54%), H335 (54%) |
This chemical does not meet GHS hazard criteria for 44.8% (39 of 87) of reports.
H315 (54%): Causes skin irritation [Warning Skin corrosion/irritation]
N-[1-(S)-Ethoxycarbonyl-3-phenylpropyl]-L-alanine · CAS 82717-96-2 · C15H21NO4. UNII 10SZ4IJ77B.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.