HuagongsheHuagongshe Chemistry Print Report · For research reference only
1-(6-Methoxy-2-naphthalenyl)-1-propanone
Acylcompound · Naproxen Impurity 12 · LABOTEST-BB LT00452201 · 6-Methoxy-2-Aletyl Naphthaiene · 6-Methoxy-2-propionylnaphthone · 6''-Methoxy-2''-propionaphthone · 2-Propinyl-6-methoxynaphthalene · 6'-Methoxy-2'-propiononaphthone
Identifiers & Physical Properties
| CAS No. | 2700-47-2 |
|---|---|
| Molecular formula | C14H14O2 |
| Average molar mass | 214.26 g/mol |
| Monoisotopic mass | 214.09937969 g/mol |
| SMILES | CCC(=O)c1ccc2cc(OC)ccc2c1 |
| InChIKey | LWOTXBQKJLOAOZ-UHFFFAOYSA-N |
| PubChem CID | 75913 |
| EC No. | 220-285-7 |
| DTXSID | DTXSID90181493 |
Chemical & Physical Properties
| XLogP | 3.3 |
|---|---|
| Topological polar surface area | 26.3 |
| Hydrogen bond donors | 0 |
| Hydrogen bond acceptors | 2 |
| Rotatable bonds | 3 |
| Heavy atoms | 16 |
| Formal charge | 0 |
| Complexity | 249 |
| Melting point | 110-112 °C(lit.) |
| Boiling point | 212-215 °C14 mm Hg(lit.) |
| Density | 1.0781 (rough estimate) |
| Refractive index | 1.5300 (estimate) |
| Storage conditions | Sealed in dry,Room Temperature |
| Appearance | Light brown to gray Solid |
| InChI | InChI=1S/C14H14O2/c1-3-14(15)12-5-4-11-9-13(16-2)7-6-10(11)8-12/h4-9H,3H2,1-2H3 |
| InChIKey | LWOTXBQKJLOAOZ-UHFFFAOYSA-N |
| SMILES | C(C1=CC=C2C(=C1)C=CC(OC)=C2)(=O)CC |
| FDA UNII | MSH38VG69W |
| UNSPSC Code | 12352100 |
| NACRES | NA.22 |
| GHS pictogram | GHS07 |
| Signal word | Warning |
| GHS hazard statements | H315-H319-H335 |
| GHS precautionary statements | P261-P264-P271-P280-P302+P352-P305+P351+P338 |
| Target organs | Respiratory system |
| Personal protective equipment (PPE) | dust mask type N95 (US), Eyeshields, Gloves |
| Hazard symbols | Xi |
| Risk statements (R) | 36/37/38 |
| Safety statements (S) | 26-37/39 |
| Water hazard class (WGK) | 3 |
| Storage class | 11 - Combustible Solids |
| Hazard class | Eye Irrit. 2Skin Irrit. 2STOT SE 3 |
Safety & Regulations
| GHS classification | WarningH315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 39 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies. |
|---|---|
| Hazard Classes and Categories | Skin Irrit. 2 (100%) |
| Personal protective equipment (PPE) | dust mask type N95 (US), Eyeshields, Gloves |
| Water hazard class (WGK) | 3 |
| Risk statements (R) | 36/37/38 |
| Signal word | Warning |
| GHS pictogram | GHS07 |
| Hazard symbols | Xi |
| Safety statements (S) | 26-37/39 |
| Storage class | 11 - Combustible Solids |
| Target organs | Respiratory system |
| GHS hazard statements | H315-H319-H335 |
| Hazard class | Eye Irrit. 2Skin Irrit. 2STOT SE 3 |
| GHS precautionary statements | P261-P264-P271-P280-P302+P352-P305+P351+P338 |
Applications & Uses
Uses
6′−Methoxy-2′−propiononaphthone is a building block useful in organic synthesis. Its density has been reported.
General Description
6′Methoxy-2′propiononaphthone is a building block useful in organic synthesis. Its density has been reported.