3-{5-[(2R)-2-Aminopropyl]-7-cyano-2,3-dihydro-1H-indol-1-yl}propy l benzoate
![3-{5-[(2R)-2-Aminopropyl]-7-cyano-2,3-dihydro-1H-indol-1-yl}propy l benzoate Structure](https://image.chemsrc.com/caspic/182/239463-72-0.png)
3-{5-[(2R)-2-Aminopropyl]-7-cyano-2,3-dihydro-1H-indol-1-yl}propy l benzoate structure
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Common Name | 3-{5-[(2R)-2-Aminopropyl]-7-cyano-2,3-dihydro-1H-indol-1-yl}propy l benzoate | ||
|---|---|---|---|---|
| CAS Number | 239463-72-0 | Molecular Weight | 363.453 | |
| Density | 1.2±0.1 g/cm3 | Boiling Point | 567.4±50.0 °C at 760 mmHg | |
| Molecular Formula | C22H25N3O2 | Melting Point | N/A | |
| MSDS | N/A | Flash Point | 296.9±30.1 °C | |
This table lists Chinese names, IUPAC names and various aliases of this chemical substance.
| Name | 3-{5-[(2R)-2-Aminopropyl]-7-cyano-2,3-dihydro-1H-indol-1-yl}propy l benzoate |
|---|---|
| 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 | 1.2±0.1 g/cm3 |
|---|---|
| Boiling Point | 567.4±50.0 °C at 760 mmHg |
| Molecular Formula | C22H25N3O2 |
| Molecular Weight | 363.453 |
| Flash Point | 296.9±30.1 °C |
| Exact Mass | 363.194672 |
| PSA | 79.35000 |
| LogP | 3.50 |
| Vapour Pressure | 0.0±1.6 mmHg at 25°C |
| Index of Refraction | 1.616 |
| InChIKey | SPIYQPPDQNLNDT-MRXNPFEDSA-N |
| SMILES | CC(N)Cc1cc(C#N)c2c(c1)CCN2CCCOC(=O)c1ccccc1 |
This table covers safety warnings, protective measures, incompatible substances and disposal guidelines for this compound.
| Hazard Codes | Xi |
|---|
This table presents publicly reported synthetic routes, reaction conditions, reactants and product information of the compound.
This table lists upstream starting materials and downstream derivative products related to this chemical.
| Precursor 9 | |
|---|---|
| DownStream 2 | |
CAS#:496-15-1
CAS#:65-85-0
CAS#:350797-53-4
CAS#:350797-54-5
CAS#:350797-56-7![5-(2-Aminopropyl)-1-[3-(benzoyloxy)propyl]-2,3-dihydro-1H-indole-7-carbonitrile Structure](https://image.chemsrc.com/caspic/028/1338365-54-0.png)
CAS#:1338365-54-0
CAS#:350797-51-2![1-[3-(Benzoyloxy)propyl]-2,3-dihydro-1H-indole-5-carboxaldehyde Structure](https://image.chemsrc.com/caspic/277/350797-52-3.png)
CAS#:350797-52-3
CAS#:1402161-28-7![1H-Indole-7-carbonitrile, 2,3-dihydro-1-(3-hydroxypropyl)-5-[(2R)-2-[[2-[2-(2,2,2-trifluoroethoxy)phenoxy]ethyl]amino]propyl] structure](https://image.chemsrc.com/caspic/018/885340-13-6.png)
CAS#:885340-13-6
CAS#:160970-54-7This table collects all English aliases, systematic names and CAS‑related synonyms of the compound.
| phenyl 2-pyridylthio ketone |
| benzoic acid 2-pyridylthio ester |
| thiobenzoic acid S-pyridin-2-yl ester |
| S-2-pyridyl 4-thiobenzoate |
| S-(2-pyridyl) benzothioate |
| 1-(3-benzoyloxypropyl)-7-cyano-5-(2R-aminopropyl)-2,3-dihydroindole |
| benzoic acid 3-[5(R)-(2-amino-propyl)-7-cyano-2,3-dihydro-indol-1-yl]-propyl ester |
| 3-{7-cyano-5-[(2R)-2-aminopropyl]-2,3-dihydro-1H-indole-1-yl}propylbenzoate |
| S-(2-pyridinyl) benzenecarbothioate |
| (R)-3-[5-(2-aminopropyl)-7-cyano-2,3-dihydro-1H-indol-1-yl]propyl benzoate |
| S-2-pyridyl benzoylthioate |
| S-2-pyridyl benzenecarbothioate |
| 3-{5-[(2R)-2-Aminopropyl]-7-cyano-2,3-dihydro-1H-indol-1-yl}propyl benzoate |
This section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.
| Q: What is the English name of 3-{5-[(2R)-2-Aminopropyl]-7-cyano-2,3-dihydro-1H-indol-1-yl}propy l benzoate? |
| A: The English name of 3-{5-[(2R)-2-Aminopropyl]-7-cyano-2,3-dihydro-1H-indol-1-yl}propy l benzoate is 3-{5-[(2R)-2-Aminopropyl]-7-cyano-2,3-dihydro-1H-indol-1-yl}propy l benzoate. |
| Q: What is the boiling point of 3-{5-[(2R)-2-Aminopropyl]-7-cyano-2,3-dihydro-1H-indol-1-yl}propy l benzoate? |
| A: Boiling point of 3-{5-[(2R)-2-Aminopropyl]-7-cyano-2,3-dihydro-1H-indol-1-yl}propy l benzoate is 567.4±50.0 °C at 760 mmHg. |
| Q: What is the molecular formula of 3-{5-[(2R)-2-Aminopropyl]-7-cyano-2,3-dihydro-1H-indol-1-yl}propy l benzoate? |
| A: Molecular formula of 3-{5-[(2R)-2-Aminopropyl]-7-cyano-2,3-dihydro-1H-indol-1-yl}propy l benzoate is C22H25N3O2. |
| Q: What is the CAS number of 3-{5-[(2R)-2-Aminopropyl]-7-cyano-2,3-dihydro-1H-indol-1-yl}propy l benzoate? |
| A: CAS number of 3-{5-[(2R)-2-Aminopropyl]-7-cyano-2,3-dihydro-1H-indol-1-yl}propy l benzoate is 239463-72-0. |
| Q: What are the downstream products of 3-{5-[(2R)-2-Aminopropyl]-7-cyano-2,3-dihydro-1H-indol-1-yl}propy l benzoate? |
| A: Related downstream products(CAS) of 3-{5-[(2R)-2-Aminopropyl]-7-cyano-2,3-dihydro-1H-indol-1-yl}propy l benzoate: 885340-13-6;160970-54-7. |
| Q: What is the polar surface area (PSA) of 3-{5-[(2R)-2-Aminopropyl]-7-cyano-2,3-dihydro-1H-indol-1-yl}propy l benzoate? |
| A: Polar surface area (PSA) of 3-{5-[(2R)-2-Aminopropyl]-7-cyano-2,3-dihydro-1H-indol-1-yl}propy l benzoate is 79.35000. |
| Q: What are the upstream materials of 3-{5-[(2R)-2-Aminopropyl]-7-cyano-2,3-dihydro-1H-indol-1-yl}propy l benzoate? |
| A: Related upstream materials(CAS) of 3-{5-[(2R)-2-Aminopropyl]-7-cyano-2,3-dihydro-1H-indol-1-yl}propy l benzoate: 496-15-1;65-85-0;350797-53-4;350797-54-5;350797-56-7;1338365-54-0;350797-51-2;350797-52-3;1402161-28-7. |
| Q: What is the molecular weight of 3-{5-[(2R)-2-Aminopropyl]-7-cyano-2,3-dihydro-1H-indol-1-yl}propy l benzoate? |
| A: Molecular weight of 3-{5-[(2R)-2-Aminopropyl]-7-cyano-2,3-dihydro-1H-indol-1-yl}propy l benzoate is 363.453. |
| Q: What is the InChIKey of 3-{5-[(2R)-2-Aminopropyl]-7-cyano-2,3-dihydro-1H-indol-1-yl}propy l benzoate? |
| A: InChIKey of 3-{5-[(2R)-2-Aminopropyl]-7-cyano-2,3-dihydro-1H-indol-1-yl}propy l benzoate is SPIYQPPDQNLNDT-MRXNPFEDSA-N. |
| Q: What is the SMILES notation of 3-{5-[(2R)-2-Aminopropyl]-7-cyano-2,3-dihydro-1H-indol-1-yl}propy l benzoate? |
| A: SMILES notation of 3-{5-[(2R)-2-Aminopropyl]-7-cyano-2,3-dihydro-1H-indol-1-yl}propy l benzoate is CC(N)Cc1cc(C#N)c2c(c1)CCN2CCCOC(=O)c1ccccc1. |
This table lists manufacturers and suppliers of this compound, including vendor names and product supply reference information.
| Shanghai Nianxing Industrial Co., Ltd |
| Dayang Chem (Hangzhou) Co., Ltd. |