tert-butyl 7-(hydroxymethyl)-3,4-dihydroisoquinoline-2(1h)-carboxylate
tert-butyl 7-(hydroxymethyl)-3,4-dihydroisoquinoline-2(1h)-carboxylate structure
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Common Name | tert-butyl 7-(hydroxymethyl)-3,4-dihydroisoquinoline-2(1h)-carboxylate | ||
|---|---|---|---|---|
| CAS Number | 960305-55-9 | Molecular Weight | 263.33200 | |
| Density | N/A | Boiling Point | N/A | |
| Molecular Formula | C15H21NO3 | Melting Point | N/A | |
| MSDS | N/A | Flash Point | N/A | |
This table lists Chinese names, IUPAC names and various aliases of this chemical substance.
| Name | tert-butyl 7-(hydroxymethyl)-3,4-dihydro-1H-isoquinoline-2-carboxylate |
|---|---|
| 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.
| Molecular Formula | C15H21NO3 |
|---|---|
| Molecular Weight | 263.33200 |
| Exact Mass | 263.15200 |
| PSA | 49.77000 |
| LogP | 2.41000 |
| InChIKey | CIBOPYLOTAXPDB-UHFFFAOYSA-N |
| SMILES | CC(C)(C)OC(=O)N1CCc2ccc(CO)cc2C1 |
| Storage condition | 2-8°C |
This table presents publicly reported synthetic routes, reaction conditions, reactants and product information of the compound.
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~92%
tert-butyl 7-(h... CAS#:960305-55-9 |
| Literature: ABBOTT GMBH and CO. KG; ABBOTT LABORATORIES; POHLKI, Frauke; AMBERG, Wilhelm; LANGE, Udo; OCHSE, Michael; BEHL, Berthold; HORNBERGER, Wilfried; MEZLER, Mario; HUTCHINS, Charles Patent: WO2012/20134 A1, 2012 ; Location in patent: Page/Page column 77-78 ; WO 2012/020134 A1 |
This table collects all English aliases, systematic names and CAS‑related synonyms of the compound.
| 2-boc-7-hydroxymethyl-1,2,3,4-tetrahydroisoquinoline |
| tert-butyl 3,4-dihydro-7-(hydroxymethyl)isoquinoline-2(1h)-carboxylate |
| 2-boc-1,2,3,4-tetrahydro-isoquinoline-7-methanol |
| tert-butyl 7-(hydroxymethyl)-3,4-dihydroisoquinoline-2(1h)-carboxylate |
| 2(1H)-Isoquinolinecarboxylic acid, 3,4-dihydro-7-(hydroxymethyl)-, 1,1-dimethylethyl ester |
This section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.
| Q: What is the molecular weight of tert-butyl 7-(hydroxymethyl)-3,4-dihydro-1H-isoquinoline-2-carboxylate? |
| A: Molecular weight of tert-butyl 7-(hydroxymethyl)-3,4-dihydro-1H-isoquinoline-2-carboxylate is 263.33200. |
| Q: What is the CAS number of tert-butyl 7-(hydroxymethyl)-3,4-dihydro-1H-isoquinoline-2-carboxylate? |
| A: CAS number of tert-butyl 7-(hydroxymethyl)-3,4-dihydro-1H-isoquinoline-2-carboxylate is 960305-55-9. |
| Q: What is the SMILES notation of tert-butyl 7-(hydroxymethyl)-3,4-dihydro-1H-isoquinoline-2-carboxylate? |
| A: SMILES notation of tert-butyl 7-(hydroxymethyl)-3,4-dihydro-1H-isoquinoline-2-carboxylate is CC(C)(C)OC(=O)N1CCc2ccc(CO)cc2C1. |
| Q: What is the LogP of tert-butyl 7-(hydroxymethyl)-3,4-dihydro-1H-isoquinoline-2-carboxylate? |
| A: LogP of tert-butyl 7-(hydroxymethyl)-3,4-dihydro-1H-isoquinoline-2-carboxylate is 2.41000. |
| Q: What is the molecular formula of tert-butyl 7-(hydroxymethyl)-3,4-dihydro-1H-isoquinoline-2-carboxylate? |
| A: Molecular formula of tert-butyl 7-(hydroxymethyl)-3,4-dihydro-1H-isoquinoline-2-carboxylate is C15H21NO3. |
| Q: What is the InChIKey of tert-butyl 7-(hydroxymethyl)-3,4-dihydro-1H-isoquinoline-2-carboxylate? |
| A: InChIKey of tert-butyl 7-(hydroxymethyl)-3,4-dihydro-1H-isoquinoline-2-carboxylate is CIBOPYLOTAXPDB-UHFFFAOYSA-N. |
| Q: What English synonyms does tert-butyl 7-(hydroxymethyl)-3,4-dihydro-1H-isoquinoline-2-carboxylate have? |
| A: English synonyms of tert-butyl 7-(hydroxymethyl)-3,4-dihydro-1H-isoquinoline-2-carboxylate: 2-boc-7-hydroxymethyl-1,2,3,4-tetrahydroisoquinoline, tert-butyl 3,4-dihydro-7-(hydroxymethyl)isoquinoline-2(1h)-carboxylate, 2-boc-1,2,3,4-tetrahydro-isoquinoline-7-methanol, tert-butyl 7-(hydroxymethyl)-3,4-dihydroisoquinoline-2(1h)-carboxylate, 2(1H)-Isoquinolinecarboxylic acid, 3,4-dihydro-7-(hydroxymethyl)-, 1,1-dimethylethyl ester. |
| Q: What are the storage conditions for tert-butyl 7-(hydroxymethyl)-3,4-dihydro-1H-isoquinoline-2-carboxylate? |
| A: Storage conditions for tert-butyl 7-(hydroxymethyl)-3,4-dihydro-1H-isoquinoline-2-carboxylate: 2-8°C. |
| Q: What is the polar surface area (PSA) of tert-butyl 7-(hydroxymethyl)-3,4-dihydro-1H-isoquinoline-2-carboxylate? |
| A: Polar surface area (PSA) of tert-butyl 7-(hydroxymethyl)-3,4-dihydro-1H-isoquinoline-2-carboxylate is 49.77000. |
| Q: What is the English name of tert-butyl 7-(hydroxymethyl)-3,4-dihydro-1H-isoquinoline-2-carboxylate? |
| A: The English name of tert-butyl 7-(hydroxymethyl)-3,4-dihydro-1H-isoquinoline-2-carboxylate is tert-butyl 7-(hydroxymethyl)-3,4-dihydro-1H-isoquinoline-2-carboxylate. |
This table lists manufacturers and suppliers of this compound, including vendor names and product supply reference information.
| Shanghai Nianxing Industrial Co., Ltd |