5-methoxy-3,4-dihydro-2H-naphthalen-1-one
5-methoxy-3,4-dihydro-2H-naphthalen-1-one structure
|
Common Name | 5-methoxy-3,4-dihydro-2H-naphthalen-1-one | ||
|---|---|---|---|---|
| CAS Number | 33892-75-0 | Molecular Weight | 176.212 | |
| Density | 1.1±0.1 g/cm3 | Boiling Point | 313.0±0.0 °C at 760 mmHg | |
| Molecular Formula | C11H12O2 | Melting Point | 87-91 °C(lit.) | |
| MSDS | Chinese USA | Flash Point | 153.1±18.4 °C | |
This table lists Chinese names, IUPAC names and various aliases of this chemical substance.
| Name | 5-methoxy-3,4-dihydro-2H-naphthalen-1-one |
|---|---|
| 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 | 1.1±0.1 g/cm3 |
|---|---|
| Boiling Point | 313.0±0.0 °C at 760 mmHg |
| Melting Point | 87-91 °C(lit.) |
| Molecular Formula | C11H12O2 |
| Molecular Weight | 176.212 |
| Flash Point | 153.1±18.4 °C |
| Exact Mass | 176.083725 |
| PSA | 26.30000 |
| LogP | 2.79 |
| Vapour Pressure | 0.0±0.6 mmHg at 25°C |
| Index of Refraction | 1.549 |
| InChIKey | BRCPWISABURVIH-UHFFFAOYSA-N |
| SMILES | COc1cccc2c1CCCC2=O |
| Storage condition | 2~8°C |
This table provides MSDS information including hazard classification, first‑aid, fire‑fighting, spill handling, operation and storage instructions.
This table summarizes toxicological test data, acute & chronic toxicity and ecological hazard parameters for this chemical.
CHEMICAL IDENTIFICATION
HEALTH HAZARD DATAACUTE TOXICITY DATA
|
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 | Xn |
| Risk Phrases | R20/21/22 |
| Safety Phrases | S22-S24/25 |
| RIDADR | NONH for all modes of transport |
| WGK Germany | 3 |
| RTECS | QK4800000 |
| HS Code | 2914509090 |
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 10 | |
CAS#:30069-58-0
CAS#:77814-39-2
CAS#:61982-91-0
CAS#:34910-81-1
CAS#:83-56-7
CAS#:33209-75-5
CAS#:623-12-1
CAS#:63213-94-5
CAS#:6342-77-4
CAS#:1008-19-1
CAS#:40771-26-4
CAS#:32940-15-1
CAS#:478-43-3
CAS#:187963-07-1
CAS#:20816-78-8
CAS#:28315-93-7
CAS#:103882-27-5
CAS#:158440-98-3
CAS#:3588-80-5This table shows customs‑related data including HS‑code, tariff and regulatory conditions for import and export.
| HS Code | 2914509090 |
|---|---|
| Summary | HS:2914509090 other ketones with other oxygen function VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:5.5% General tariff:30.0% |
This table collects all English aliases, systematic names and CAS‑related synonyms of the compound.
| 5-methoxy-3,4-dihydronaphthalene-1-one |
| 5-methoxy-3,4-dihydronaphthalenone |
| EINECS 251-723-5 |
| 5-methoxy-3,4-dihydronaphthalen-1(2H)-one |
| 5-Methoxytetralone |
| 3,4-Dihydro-5-methoxy-1(2H)-naphthalenone |
| 5-Methoxy-3,4-dihydro-1(2H)-naphthalenone |
| 5-methoxy-1-oxo-1,2,3,4-tetrahydronaphthalene |
| 5-Methoxy-1,2,3,4-tetrahydronaphthalen-1-one |
| 5-Methoxy-1-tetralone |
| 5-methoxy-1,2,3,4-tetrahydro-1-naphthalenone |
| MFCD00001692 |
This section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.
| Q: What is the InChIKey of 5-methoxy-3,4-dihydro-2H-naphthalen-1-one? |
| A: InChIKey of 5-methoxy-3,4-dihydro-2H-naphthalen-1-one is BRCPWISABURVIH-UHFFFAOYSA-N. |
| Q: What is the molecular weight of 5-methoxy-3,4-dihydro-2H-naphthalen-1-one? |
| A: Molecular weight of 5-methoxy-3,4-dihydro-2H-naphthalen-1-one is 176.212. |
| Q: What is the LogP of 5-methoxy-3,4-dihydro-2H-naphthalen-1-one? |
| A: LogP of 5-methoxy-3,4-dihydro-2H-naphthalen-1-one is 2.79. |
| Q: What are the upstream materials of 5-methoxy-3,4-dihydro-2H-naphthalen-1-one? |
| A: Related upstream materials(CAS) of 5-methoxy-3,4-dihydro-2H-naphthalen-1-one: 30069-58-0;77814-39-2;61982-91-0;34910-81-1;83-56-7;33209-75-5;623-12-1;63213-94-5;6342-77-4. |
| Q: What is the safety information for 5-methoxy-3,4-dihydro-2H-naphthalen-1-one? |
| A: Safety information for 5-methoxy-3,4-dihydro-2H-naphthalen-1-one: S22-S24/25. |
| Q: What is the SMILES notation of 5-methoxy-3,4-dihydro-2H-naphthalen-1-one? |
| A: SMILES notation of 5-methoxy-3,4-dihydro-2H-naphthalen-1-one is COc1cccc2c1CCCC2=O. |
| Q: What are the downstream products of 5-methoxy-3,4-dihydro-2H-naphthalen-1-one? |
| A: Related downstream products(CAS) of 5-methoxy-3,4-dihydro-2H-naphthalen-1-one: 1008-19-1;40771-26-4;32940-15-1;478-43-3;187963-07-1;20816-78-8;28315-93-7;103882-27-5;158440-98-3;3588-80-5. |
| Q: What is the polar surface area (PSA) of 5-methoxy-3,4-dihydro-2H-naphthalen-1-one? |
| A: Polar surface area (PSA) of 5-methoxy-3,4-dihydro-2H-naphthalen-1-one is 26.30000. |
| Q: What is the boiling point of 5-methoxy-3,4-dihydro-2H-naphthalen-1-one? |
| A: Boiling point of 5-methoxy-3,4-dihydro-2H-naphthalen-1-one is 313.0±0.0 °C at 760 mmHg. |
| Q: What is the CAS number of 5-methoxy-3,4-dihydro-2H-naphthalen-1-one? |
| A: CAS number of 5-methoxy-3,4-dihydro-2H-naphthalen-1-one is 33892-75-0. |
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. |