Acetic acid,2-[(2-cyanoethyl)thio]-, ethyl ester
Modify Date: 2026-04-05 19:34:09
![Acetic acid,2-[(2-cyanoethyl)thio]-, ethyl ester Structure](https://image.chemsrc.com/caspic/061/5331-38-4.png)
Acetic acid,2-[(2-cyanoethyl)thio]-, ethyl ester structure
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Common Name | Acetic acid,2-[(2-cyanoethyl)thio]-, ethyl ester | ||
|---|---|---|---|---|
| CAS Number | 5331-38-4 | Molecular Weight | 173.23300 | |
| Density | 1.118g/cm3 | Boiling Point | 287.2ºC at 760mmHg | |
| Molecular Formula | C7H11NO2S | Melting Point | N/A | |
| MSDS | N/A | Flash Point | 127.5ºC | |
| Name | [(2-cyanoethyl)thio]acetic acid, ethyl ester |
|---|---|
| Synonym | More Synonyms |
| Density | 1.118g/cm3 |
|---|---|
| Boiling Point | 287.2ºC at 760mmHg |
| Molecular Formula | C7H11NO2S |
| Molecular Weight | 173.23300 |
| Flash Point | 127.5ºC |
| Exact Mass | 173.05100 |
| PSA | 75.39000 |
| LogP | 1.19638 |
| Index of Refraction | 1.481 |
| InChIKey | HGDQWBAREHCJCE-UHFFFAOYSA-N |
| SMILES | CCOC(=O)CSCCC#N |
| HS Code | 2930909090 |
|---|
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~90%
Acetic acid,2-[... CAS#:5331-38-4 |
| Literature: Bell, Richard; Cottam, Peter D.; Davies, John; Jones, D. Neville Journal of the Chemical Society, Perkin Transactions 1: Organic and Bio-Organic Chemistry (1972-1999), 1981 , # 7 p. 2106 - 2115 |
| Precursor 2 | |
|---|---|
| DownStream 1 | |
CAS#:61404-34-0| HS Code | 2930909090 |
|---|---|
| Summary | 2930909090. other organo-sulphur compounds. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:30.0% |
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Name: NCI human tumor cell line growth inhibition assay. Data for the MCF7 Non-Small Cell L...
Source: DTP/NCI
Target: N/A
External Id: MCF7_OneDose
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Name: NCI human tumor cell line growth inhibition assay. Data for the IGROV1 Non-Small Cell...
Source: DTP/NCI
Target: N/A
External Id: IGROV1_OneDose
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| Ethanaminium,2-cyano-N,N,N-trimethyl-,chloride |
| 1-Cyanoethyl-thioessigsaeure-ethylester |