111139-55-0
111139-55-0 structure
- Name: 3-(1-Benzothiophen-3-yl)-L-alanine
- Chemical Name: 3-(3-Benzothienyl)-D-alanine
- CAS Number: 111139-55-0
- Molecular Formula: C11H11NO2S
- Molecular Weight: 221.275
- Create Date: 2018-09-19 02:00:54
- Modify Date: 2024-01-06 17:49:41
| Name | 3-(3-Benzothienyl)-D-alanine |
|---|---|
| Synonyms |
(2R)-2-Amino-3-(1-benzothiophen-2-yl)propanoic acid
(2S)-2-amino-3-(1-benzothiophen-3-yl)propanoic acid T56 BSJ D1YZVQ &&L or S Form (αS)-α-Amino-benzo[b]thiophene-3-propanoic acid Benzo[b]thiophene-2-propanoic acid, α-amino-, (αR)- (2R)-2-amino-3-(1-benzothiophen-3-yl)propanoic acid 3-(1-Benzothiophen-3-yl)-L-alanine EINECS 207-715-9 3-(1-Benzothiophen-2-yl)-D-alanin Benzo[b]thiophene-3-propanoic acid, α-amino-, (αS)- MFCD00002435 3-(1-Benzothiophen-2-yl)-D-alanine Benzo(b)thiophene-3-propanoic acid, α-amino- |
| Density | 1.4±0.1 g/cm3 |
|---|---|
| Boiling Point | 416.7±35.0 °C at 760 mmHg |
| Melting Point | 143-145ºC |
| Molecular Formula | C11H11NO2S |
| Molecular Weight | 221.275 |
| Flash Point | 205.8±25.9 °C |
| Exact Mass | 221.051056 |
| PSA | 91.56000 |
| LogP | 3.28 |
| Vapour Pressure | 0.0±1.0 mmHg at 25°C |
| Index of Refraction | 1.692 |
| Storage condition | Store at RT. |
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~%
111139-55-0 |
| Literature: Kawakubo, Hiromu; Takagi, Seiji; Yamaura, Yuuji; Katoh, Shinichi; Ishimoto, Yumiko; et al. Journal of Medicinal Chemistry, 1993 , vol. 36, # 23 p. 3526 - 3532 |
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111139-55-0 |
| Literature: Journal of Medicinal Chemistry, , vol. 36, # 23 p. 3526 - 3532 |
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111139-55-0 |
| Literature: Chemistry - A European Journal, , vol. 12, # 10 p. 2739 - 2744 |
| Precursor 2 | |
|---|---|
| DownStream 0 | |
| HS Code | 2934999090 |
|---|---|
| Summary | 2934999090. other heterocyclic compounds. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0% |