(S)-(-)- 6,7-DIMETHOXY-1,2,3,4-TETRAHYDROISOQUINOLINE-3- CARBOXYLIC ACID HYDROCHLORIDE
(S)-(-)- 6,7-DIMETHOXY-1,2,3,4-TETRAHYDROISOQUINOLINE-3- CARBOXYLIC ACID HYDROCHLORIDE structure
|
Common Name | (S)-(-)- 6,7-DIMETHOXY-1,2,3,4-TETRAHYDROISOQUINOLINE-3- CARBOXYLIC ACID HYDROCHLORIDE | ||
|---|---|---|---|---|
| CAS Number | 82586-62-7 | Molecular Weight | 273.713 | |
| Density | N/A | Boiling Point | 434.8ºC at 760 mmHg | |
| Molecular Formula | C12H16ClNO4 | Melting Point | >300 °C(lit.) | |
| MSDS | Chinese USA | Flash Point | 216.7ºC | |
This table lists Chinese names, IUPAC names and various aliases of this chemical substance.
| Name | 1,2,3,4-Tetrahydro-6,7-dimethoxy-3-isoquinolinecarboxylic acid hydrochloride |
|---|---|
| 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.
| Boiling Point | 434.8ºC at 760 mmHg |
|---|---|
| Melting Point | >300 °C(lit.) |
| Molecular Formula | C12H16ClNO4 |
| Molecular Weight | 273.713 |
| Flash Point | 216.7ºC |
| Exact Mass | 273.076782 |
| PSA | 67.79000 |
| LogP | 1.93350 |
| InChIKey | ROWPWZMWICGKBY-FVGYRXGTSA-N |
| SMILES | COc1cc2c(cc1OC)CC(C(=O)O)NC2.Cl |
| Storage condition | Hygroscopic, Refrigerator, Under Inert Atmosphere |
This table provides MSDS information including hazard classification, first‑aid, fire‑fighting, spill handling, operation and storage instructions.
This table covers safety warnings, protective measures, incompatible substances and disposal guidelines for this compound.
| Personal Protective Equipment | Eyeshields;Gloves;type N95 (US);type P1 (EN143) respirator filter |
|---|---|
| Hazard Codes | Xi: Irritant; |
| Risk Phrases | R36/37/38 |
| Safety Phrases | S26-S36 |
| RIDADR | NONH for all modes of transport |
| WGK Germany | 3 |
| HS Code | 2933499090 |
This table presents publicly reported synthetic routes, reaction conditions, reactants and product information of the compound.
|
~93%
(S)-(-)- 6,7-DI... CAS#:82586-62-7 |
| Literature: BRANTFORD CHEMICALS INC. Patent: WO2003/101967 A1, 2003 ; Location in patent: Page 16 ; |
|
~%
(S)-(-)- 6,7-DI... CAS#:82586-62-7 |
| Literature: Synthesis, , # 7 p. 550 - 556 |
|
~%
(S)-(-)- 6,7-DI... CAS#:82586-62-7 |
| Literature: Synthesis, , # 7 p. 550 - 556 |
|
~%
(S)-(-)- 6,7-DI... CAS#:82586-62-7 |
| Literature: Synthesis, , # 7 p. 550 - 556 |
|
~%
(S)-(-)- 6,7-DI... CAS#:82586-62-7 |
| Literature: Synthesis, , # 7 p. 550 - 556 |
|
~%
(S)-(-)- 6,7-DI... CAS#:82586-62-7 |
| Literature: Synthesis, , # 7 p. 550 - 556 |
|
~%
(S)-(-)- 6,7-DI... CAS#:82586-62-7 |
| Literature: Chemical Communications, , vol. 47, # 38 p. 10746 - 10748 |
This table lists upstream starting materials and downstream derivative products related to this chemical.
| Precursor 8 | |
|---|---|
| DownStream 0 | |
This table shows customs‑related data including HS‑code, tariff and regulatory conditions for import and export.
| HS Code | 2933499090 |
|---|---|
| Summary | 2933499090. other compounds containing in the structure a quinoline or isoquinoline ring-system (whether or not hydrogenated), not further fused. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0% |
This table collects all English aliases, systematic names and CAS‑related synonyms of the compound.
| (3S)-6,7-Dimethoxy-1,2,3,4-tetrahydroisoquinoline-3-carboxylic acid hydrochloride (1:1) |
| 1,2,3,4-TETRAHYDROISOQUINOLINE-3-CARBOXYLIC ACID HYDROCHORIDE |
| (S)-(-)-6,7-DIMETHOX-1,2,3,4-TETRAHYDROI |
| 6,7-DIMETHOXY-1,2,3,4-TETRAHYDROISOQUINOLINE-3-CARBOXYLIC ACID HYDROCHORIDE |
| (S)-1,2,3,4-tetrahydro-6,7-dimethoxy-3-isoquinolinecarboxylic acid hydrochloride |
| S-6,7-dimethoxy-1,2,3,4-Tetrahydro-3-isoquinolinecarboxylicacidHCl |
| (3S)-6,7-Dimethoxy-1,2,3,4-tetrahydro-3-isoquinolinecarboxylic acid hydrochloride (1:1) |
| (S)-(-)-6,7-Dimethoxy-1,2,3,4-Tetrahydroisoquinoline-3-Carboxylic Acid HCl |
| MFCD00012743 |
| 3-Isoquinolinecarboxylic acid, 1,2,3,4-tetrahydro-6,7-dimethoxy-, (3S)-, hydrochloride (1:1) |
| (S)-1,2,3,4-tetrahydro-6,7-dimethoxy-3-isoquinolinecarboxylic acid |
| DL-1,2,3,4-TETRAHYDROISOQUINOLINE-3-CARBOXYLIC ACID HYDROCHLORIDE |
| EINECS 255-610-1 |
| (S)-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinoline-3-carboxylic acid hydrochloride |
| 1,2,3,4-TETRAHYDROISOQUINOLINE-3-CARBOXYLIC ACID HYDROCHLORIDE |
| (3S)-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinoline-3-carboxylic acid hydrochloride |
| (S)-6,7-dimethoxy-1,2,3,4-tetrahydro-3-isoquinolinecarboxylic acid hydrochloride |
| 1,2,3,4-TETRAHYDRO-3-ISOQUINOLINECARBOXYLIC ACID HYDROCHLORIDE |
| (S)-(-)- 6,7-DIMETHOXY-1,2,3,4-TETRAHYDROISOQUINOLINE-3- CARBOXYLIC ACID HYDROCHLORIDE |
This section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.
| Q: What are the storage conditions for 1,2,3,4-Tetrahydro-6,7-dimethoxy-3-isoquinolinecarboxylic acid hydrochloride? |
| A: Storage conditions for 1,2,3,4-Tetrahydro-6,7-dimethoxy-3-isoquinolinecarboxylic acid hydrochloride: Hygroscopic, Refrigerator, Under Inert Atmosphere. |
| Q: What is the CAS number of 1,2,3,4-Tetrahydro-6,7-dimethoxy-3-isoquinolinecarboxylic acid hydrochloride? |
| A: CAS number of 1,2,3,4-Tetrahydro-6,7-dimethoxy-3-isoquinolinecarboxylic acid hydrochloride is 82586-62-7. |
| Q: What is the boiling point of 1,2,3,4-Tetrahydro-6,7-dimethoxy-3-isoquinolinecarboxylic acid hydrochloride? |
| A: Boiling point of 1,2,3,4-Tetrahydro-6,7-dimethoxy-3-isoquinolinecarboxylic acid hydrochloride is 434.8ºC at 760 mmHg. |
| Q: What are the upstream materials of 1,2,3,4-Tetrahydro-6,7-dimethoxy-3-isoquinolinecarboxylic acid hydrochloride? |
| A: Related upstream materials(CAS) of 1,2,3,4-Tetrahydro-6,7-dimethoxy-3-isoquinolinecarboxylic acid hydrochloride: 358627-67-5;25349-37-5;76313-29-6;120-14-9;109278-11-7;50-00-0;69274-24-4;138908-56-2. |
| Q: What is the SMILES notation of 1,2,3,4-Tetrahydro-6,7-dimethoxy-3-isoquinolinecarboxylic acid hydrochloride? |
| A: SMILES notation of 1,2,3,4-Tetrahydro-6,7-dimethoxy-3-isoquinolinecarboxylic acid hydrochloride is COc1cc2c(cc1OC)CC(C(=O)O)NC2.Cl. |
| Q: What is the safety information for 1,2,3,4-Tetrahydro-6,7-dimethoxy-3-isoquinolinecarboxylic acid hydrochloride? |
| A: Safety information for 1,2,3,4-Tetrahydro-6,7-dimethoxy-3-isoquinolinecarboxylic acid hydrochloride: S26-S36. |
| Q: What is the polar surface area (PSA) of 1,2,3,4-Tetrahydro-6,7-dimethoxy-3-isoquinolinecarboxylic acid hydrochloride? |
| A: Polar surface area (PSA) of 1,2,3,4-Tetrahydro-6,7-dimethoxy-3-isoquinolinecarboxylic acid hydrochloride is 67.79000. |
| Q: What is the melting point of 1,2,3,4-Tetrahydro-6,7-dimethoxy-3-isoquinolinecarboxylic acid hydrochloride? |
| A: Melting point of 1,2,3,4-Tetrahydro-6,7-dimethoxy-3-isoquinolinecarboxylic acid hydrochloride is >300 °C(lit.). |
| Q: What is the InChIKey of 1,2,3,4-Tetrahydro-6,7-dimethoxy-3-isoquinolinecarboxylic acid hydrochloride? |
| A: InChIKey of 1,2,3,4-Tetrahydro-6,7-dimethoxy-3-isoquinolinecarboxylic acid hydrochloride is ROWPWZMWICGKBY-FVGYRXGTSA-N. |
| Q: What is the LogP of 1,2,3,4-Tetrahydro-6,7-dimethoxy-3-isoquinolinecarboxylic acid hydrochloride? |
| A: LogP of 1,2,3,4-Tetrahydro-6,7-dimethoxy-3-isoquinolinecarboxylic acid hydrochloride is 1.93350. |
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. |