HuagongsheHuagongshe Chemistry Print Report · For research reference only
4-Sulfanylbutan-1-ol
4-Mercaptobutan-1-ol · 4-Mercapto-1-butanol · 4-sulfanylbutan-1-ol · 1-Butanol, 4-mercapto- · 4-Mercapto-1-butanol 95% · 4-MERCAPTO-1-BUTANOL 97+%
Identifiers & Physical Properties
| CAS No. | 14970-83-3 |
|---|---|
| Molecular formula | C4H10OS |
| Average molar mass | 106.19 g/mol |
| Monoisotopic mass | 106.04523594 g/mol |
| SMILES | OCCCCS |
| InChIKey | NEJMTSWXTZREOC-UHFFFAOYSA-N |
| PubChem CID | 548261 |
| EC No. | 628-399-2 |
| DTXSID | DTXSID00338310 |
Chemical & Physical Properties
| XLogP | 0.1 |
|---|---|
| Topological polar surface area | 21.2 |
| Hydrogen bond donors | 2 |
| Hydrogen bond acceptors | 2 |
| Rotatable bonds | 3 |
| Heavy atoms | 6 |
| Formal charge | 0 |
| Complexity | 23.5 |
| Melting point | -100°C (estimate) |
| Boiling point | 102-103 °C20 mm Hg(lit.) |
| Density | 1.03 g/mL at 25 °C(lit.) |
| Refractive index | n20/D 1.494(lit.) |
| Flash point | 202 °F |
| Physical state | liquid (estimate) |
| pKa (acidity coefficient) | 10.33±0.10(Predicted) |
| InChI | InChI=1S/C4H10OS/c5-3-1-2-4-6/h5-6H,1-4H2 |
| InChIKey | NEJMTSWXTZREOC-UHFFFAOYSA-N |
| SMILES | C(O)CCCS |
| UNSPSC Code | 12352103 |
| GHS pictogram | GHS07 |
| Signal word | Warning |
| GHS hazard statements | H315-H319-H335 |
| GHS precautionary statements | P261-P305+P351+P338 |
| Target organs | Respiratory system |
| Personal protective equipment (PPE) | Eyeshields, Gloves, type ABEK (EN14387) respirator filter |
| Hazard symbols | Xi |
| Risk statements (R) | 36/37/38 |
| Safety statements (S) | 26-36 |
| UN transport number | UN 3334 |
| Water hazard class (WGK) | 3 |
| F | 10-13-23 |
| Storage class | 10 - Combustible liquids |
| 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 43 reports by companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies. |
|---|---|
| Hazard Classes and Categories | Skin Irrit. 2 (100%) |
| F | 10-13-23 |
| Personal protective equipment (PPE) | Eyeshields, Gloves, type ABEK (EN14387) respirator filter |
| Water hazard class (WGK) | 3 |
| UN transport number | UN 3334 |
| Risk statements (R) | 36/37/38 |
| Signal word | Warning |
| GHS pictogram | GHS07 |
| Hazard symbols | Xi |
| Safety statements (S) | 26-36 |
| Storage class | 10 - Combustible liquids |
| Target organs | Respiratory system |
| GHS hazard statements | H315-H319-H335 |
| Hazard class | Eye Irrit. 2Skin Irrit. 2STOT SE 3 |
| GHS precautionary statements | P261-P305+P351+P338 |
Applications & Uses
Uses
Used to form a hydrophilic sparse ionic monolayer to protected metal nanoparticles to create Highly Concentrated Nano-Au and Nano-Ag "Inks" that can be Sintered to Near-Bulk Conductivity at 150 °C.