H-.beta.-(2-Thienyl)-D-Ala-OH (CAS 62561-76-6) — formula C7H9NO2S, molecular weight 171.22; category organic chemicals.
H-.beta.-(2-Thienyl)-D-Ala-OH is a carbon-based organic compound with CAS registry number 62561-76-6 and molecular formula C7H9NO2S (molecular weight 171.22), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 62561-76-6
Its molecular formula C7H9NO2S comprises 7 C, 9 H, 1 N, 2 O, 1 S atoms.
Also known as: H-.beta.-(2-Thienyl)-D-Ala-OH · D-3-(2-Thienyl)alanine
Category: organic chemicals
The CAS registry number of H-.beta.-(2-Thienyl)-D-Ala-OH is 62561-76-6.
Molecular formula C7H9NO2S, molecular weight 171.22.
It is also registered under: H-.beta.-(2-Thienyl)-D-Ala-OH, D-3-(2-Thienyl)alanine.
Category: Organic Chemicals.
Public-database records for H-.beta.-(2-Thienyl)-D-Ala-OH (CAS 62561-76-6), reproduced here for independent cross-checking.
| Reported hazard statements | H315 (100%), H319 (100%), H335 (100%) |
|---|
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]
| CAS Registry Number | 62561-76-6 |
|---|---|
| PubChem CID | 7111750 |
| 分子式 | C7H9NO2S |
| IUPAC 名称 | (2R)-2-amino-3-thiophen-2-ylpropanoic acid |
| UNII（FDA） | PJ4EM0CL5E |
3-(2-Thienyl)-D-alanine; 62561-76-6; beta-(2-Thienyl)-D-alanine; d-3-(2-thienyl)alanine; beta-2-thienyl-D-alanine; PJ4EM0CL5E; UNII-PJ4EM0CL5E; 3-(2-thiophenyl)-D-alanine; beta-(2-thiophenyl)-D-alanine; (2R)-2-amino-3-(2-thienyl)propanoic acid; CHEBI:77819; .BETA.-2-THIENYL-D-ALANINE; .BETA.-(2-THIENYL)-D-ALANINE; 2-Thiophenepropanoic acid, alpha-amino-, (alphaR)-; 2-THIOPHENEPROPANOIC ACID, .ALPHA.-AMINO-, (.ALPHA.R)-; RefChem:199802
| 分子量 | 171.22 |
|---|---|
| XLogP3 | -1.7 |
| 氢键供体数 | 2 |
| 氢键受体数 | 4 |
| 可旋转键数 | 3 |
| 精确质量 | 171.03539970 |
| 单同位素质量 | 171.03539970 |
| 拓扑极性表面积 | 91.6 |
| 重原子数 | 11 |
| 形式电荷 | 0 |
H-.beta.-(2-Thienyl)-D-Ala-OH · CAS 62561-76-6 · C7H9NO2S. UNII PJ4EM0CL5E.
Source: PubChem / Wikidata; the batch COA governs where values differ.
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