2-(3-sulfanylpropanoyl)-3,4-dihydro-1H-isoquinoline-1-carboxylic acid
2-(3-sulfanylpropanoyl)-3,4-dihydro-1H-isoquinoline-1-carboxylic acid structure
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Common Name | 2-(3-sulfanylpropanoyl)-3,4-dihydro-1H-isoquinoline-1-carboxylic acid | ||
|---|---|---|---|---|
| CAS Number | 92932-75-7 | Molecular Weight | 265.32800 | |
| Density | 1.317g/cm3 | Boiling Point | 520.6ºC at 760 mmHg | |
| Molecular Formula | C13H15NO3S | Melting Point | N/A | |
| MSDS | N/A | Flash Point | 268.6ºC | |
This table lists Chinese names, IUPAC names and various aliases of this chemical substance.
| Name | 2-(3-sulfanylpropanoyl)-3,4-dihydro-1H-isoquinoline-1-carboxylic acid |
|---|---|
| Synonym | More Synonyms |
This table shows physicochemical parameters including melting point, boiling point, density, solubility and optical rotation. Missing data is marked as N/A.
| Density | 1.317g/cm3 |
|---|---|
| Boiling Point | 520.6ºC at 760 mmHg |
| Molecular Formula | C13H15NO3S |
| Molecular Weight | 265.32800 |
| Flash Point | 268.6ºC |
| Exact Mass | 265.07700 |
| PSA | 96.41000 |
| LogP | 1.45480 |
| Index of Refraction | 1.61 |
| InChIKey | ARBBMPDGVLNWHA-UHFFFAOYSA-N |
| SMILES | O=C(O)C1c2ccccc2CCN1C(=O)CCS |
This table presents publicly reported synthetic routes, reaction conditions, reactants and product information of the compound.
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2-(3-sulfanylpr... CAS#:92932-75-7 |
| Literature: Stanton; Gruenfeld; Babiarz; Ackerman; Friedmann; Yuan; Macchia Journal of Medicinal Chemistry, 1983 , vol. 26, # 9 p. 1267 - 1277 |
This table collects all English aliases, systematic names and CAS‑related synonyms of the compound.
| eu-4881 |
This section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.
| Q: What is the CAS number of 2-(3-sulfanylpropanoyl)-3,4-dihydro-1H-isoquinoline-1-carboxylic acid? |
| A: CAS number of 2-(3-sulfanylpropanoyl)-3,4-dihydro-1H-isoquinoline-1-carboxylic acid is 92932-75-7. |
| Q: What is the LogP of 2-(3-sulfanylpropanoyl)-3,4-dihydro-1H-isoquinoline-1-carboxylic acid? |
| A: LogP of 2-(3-sulfanylpropanoyl)-3,4-dihydro-1H-isoquinoline-1-carboxylic acid is 1.45480. |
| Q: What is the molecular weight of 2-(3-sulfanylpropanoyl)-3,4-dihydro-1H-isoquinoline-1-carboxylic acid? |
| A: Molecular weight of 2-(3-sulfanylpropanoyl)-3,4-dihydro-1H-isoquinoline-1-carboxylic acid is 265.32800. |
| Q: What is the SMILES notation of 2-(3-sulfanylpropanoyl)-3,4-dihydro-1H-isoquinoline-1-carboxylic acid? |
| A: SMILES notation of 2-(3-sulfanylpropanoyl)-3,4-dihydro-1H-isoquinoline-1-carboxylic acid is O=C(O)C1c2ccccc2CCN1C(=O)CCS. |
| Q: What English synonyms does 2-(3-sulfanylpropanoyl)-3,4-dihydro-1H-isoquinoline-1-carboxylic acid have? |
| A: English synonyms of 2-(3-sulfanylpropanoyl)-3,4-dihydro-1H-isoquinoline-1-carboxylic acid: eu-4881. |
| Q: What is the InChIKey of 2-(3-sulfanylpropanoyl)-3,4-dihydro-1H-isoquinoline-1-carboxylic acid? |
| A: InChIKey of 2-(3-sulfanylpropanoyl)-3,4-dihydro-1H-isoquinoline-1-carboxylic acid is ARBBMPDGVLNWHA-UHFFFAOYSA-N. |
| Q: What is the English name of 2-(3-sulfanylpropanoyl)-3,4-dihydro-1H-isoquinoline-1-carboxylic acid? |
| A: The English name of 2-(3-sulfanylpropanoyl)-3,4-dihydro-1H-isoquinoline-1-carboxylic acid is 2-(3-sulfanylpropanoyl)-3,4-dihydro-1H-isoquinoline-1-carboxylic acid. |
| Q: What is the molecular formula of 2-(3-sulfanylpropanoyl)-3,4-dihydro-1H-isoquinoline-1-carboxylic acid? |
| A: Molecular formula of 2-(3-sulfanylpropanoyl)-3,4-dihydro-1H-isoquinoline-1-carboxylic acid is C13H15NO3S. |
| Q: What is the polar surface area (PSA) of 2-(3-sulfanylpropanoyl)-3,4-dihydro-1H-isoquinoline-1-carboxylic acid? |
| A: Polar surface area (PSA) of 2-(3-sulfanylpropanoyl)-3,4-dihydro-1H-isoquinoline-1-carboxylic acid is 96.41000. |
| Q: What is the Chinese name of 92932-75-7? |
| A: Chinese name of 92932-75-7 is 92932-75-7. |