fmoc-3-(3-benzothienyl)-D-alanine (CAS 177966-61-9) — formula C26H21NO4S, molecular weight 443.5; category organic chemicals.
fmoc-3-(3-benzothienyl)-D-alanine is a carbon-based organic compound with CAS registry number 177966-61-9 and molecular formula C26H21NO4S (molecular weight 443.5), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 177966-61-9
Its molecular formula C26H21NO4S comprises 26 C, 21 H, 1 N, 4 O, 1 S atoms.
Also known as: fmoc-3-(3-benzothienyl)-D-alanine · Fmoc-D-3-Benzothienylalanine
Category: organic chemicals
The CAS registry number of fmoc-3-(3-benzothienyl)-D-alanine is 177966-61-9.
Molecular formula C26H21NO4S, molecular weight 443.5.
It is also registered under: fmoc-3-(3-benzothienyl)-D-alanine, Fmoc-D-3-Benzothienylalanine.
Category: Organic Chemicals.
Public-database records for fmoc-3-(3-benzothienyl)-D-alanine (CAS 177966-61-9), reproduced here for independent cross-checking.
| Reported hazard statements | H302 (100%), H315 (100%), H319 (100%), H335 (100%) |
|---|
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
| CAS Registry Number | 177966-61-9 |
|---|---|
| PubChem CID | 7033157 |
| 分子式 | C26H21NO4S |
| IUPAC 名称 | (2R)-3-(1-benzothiophen-3-yl)-2-(9H-fluoren-9-ylmethoxycarbonylamino)propanoic acid |
(2R)-3-(1-benzothiophen-3-yl)-2-(9H-fluoren-9-ylmethoxycarbonylamino)propanoic acid; RefChem:397314; 821-761-2; 177966-61-9; (R)-2-((((9H-Fluoren-9-yl)methoxy)carbonyl)amino)-3-(benzo[b]thiophen-3-yl)propanoic acid; FMOC-D-3-BENZOTHIENYLALANINE; Fmoc-3-(3-benzothienyl)-D-alanine; MFCD00672563; Benzo[b]thiophene-3-propanoic acid, alpha-[[(9H-fluoren-9-ylmethoxy)carbonyl]amino]-, (alphaR)-; Fmoc-D-Bta-OH; SCHEMBL799761; SCHEMBL29511478; SCHEMBL30182933; Fmoc--(3-benzothienyl)-Ala-OH; DTXSID401131004; Fmoc--(3-benzothienyl)-D-Ala-OH
| 分子量 | 443.5 |
|---|---|
| XLogP3 | 5.7 |
| 氢键供体数 | 2 |
| 氢键受体数 | 5 |
| 可旋转键数 | 7 |
| 精确质量 | 443.11912932 |
| 单同位素质量 | 443.11912932 |
| 拓扑极性表面积 | 104 |
| 重原子数 | 32 |
| 形式电荷 | 0 |
fmoc-3-(3-benzothienyl)-D-alanine · CAS 177966-61-9 · C26H21NO4S.
Source: PubChem / Wikidata; the batch COA governs where values differ.
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