HuagongsheHuagongshe Chemistry Print Report · For research reference only
6-Hydroxymethylindole
6-IndolMethanol · INDOLE-6-METHANOL · RARECHEM AL BD 1265 · 1H-Indole-6-methanol · 6-Hydroxymethylindole · (1H-indol-6-yl)methanol · 6-(Hydroxymethyl)-1H-indole · 1H-indol-6-ylmethanol - [H2307]
Identifiers & Physical Properties
| CAS No. | 1075-26-9 |
|---|---|
| Molecular formula | C9H9NO |
| Average molar mass | 147.17 g/mol |
| Monoisotopic mass | 147.06841391 g/mol |
| SMILES | OCc1ccc2cc[nH]c2c1 |
| InChIKey | WRMZOPANDOHWJU-UHFFFAOYSA-N |
| PubChem CID | 2773459 |
| EC No. | 106-721-8 |
| DTXSID | DTXSID00378473 |
Chemical & Physical Properties
| XLogP | 2.1 |
|---|---|
| Topological polar surface area | 36 |
| Hydrogen bond donors | 2 |
| Hydrogen bond acceptors | 1 |
| Rotatable bonds | 1 |
| Heavy atoms | 11 |
| Formal charge | 0 |
| Complexity | 138 |
| Melting point | 45-50°C |
| Boiling point | 360.6±17.0 °C(Predicted) |
| Density | 1.272±0.06 g/cm3(Predicted) |
| Storage conditions | 2-8°C |
| pKa (acidity coefficient) | 14.56±0.10(Predicted) |
| Physical state | solid |
| Color | Beige |
| CAS DataBase Reference | 1075-26-9(CAS DataBase Reference) |
| GHS pictogram | GHS07 |
| Signal word | Warning |
| GHS hazard statements | H315-H319-H335 |
| GHS precautionary statements | P261-P271-P280 |
| Hazard symbols | Xi |
| Risk statements (R) | 37/38-41 |
| Safety statements (S) | 24/25-39-26 |
| Hazard class | IRRITANT |
| Customs code | 2933998090 |
Safety & Regulations
| GHS classification | DangerH315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P354+P338, P317, P319, P321, P332+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory. |
|---|---|
| Hazard Classes and Categories | Skin Irrit. 2 (100%) |
| Customs code | 2933998090 |
| Risk statements (R) | 37/38-41 |
| Signal word | Warning |
| GHS pictogram | GHS07 |
| Hazard symbols | Xi |
| Safety statements (S) | 24/25-39-26 |
| Hazard class | IRRITANT |
| GHS hazard statements | H315-H319-H335 |
| GHS precautionary statements | P261-P271-P280 |
Applications & Uses
Uses
6-Hydroxymethylindole is an indole compound that is used as a pharmaceutical intermediate, for example, in the preparation of Acc inhibitors or viral replication inhibitors.