Thiophenol
ALDRICH/T32808 - 97%
Synonym: Benzenethiol; Phenyl mercaptan
CAS Number: 108-98-5
Empirical Formula (Hill Notation): C6H6S
Molecular Weight: 110.18
EC Number: 203-635-3
MDL Number: MFCD00004826
Linear Formula: C6H5SH
Product Type: Chemical
| assay | 97% |
| bp | 169 °C (lit.) |
| density | 1.073 g/mL at 25 °C (lit.) |
| InChI | 1S/C6H6S/c7-6-4-2-1-3-5-6 |
| InChI key | RMVRSNDYEFQCLF-UHFFFAOYSA |
| mp | −15 °C (lit.) |
| Quality Level | 100  |
| refractive index | n |
| SMILES string | Sc1ccccc1 |
| vapor density | 3.8 (vs air) |
| vapor pressure | 1.4 mmHg ( 20 °C) |
| Application: | Thiophenol can undergo: • Asymmetric Michael addition to diisopropyl maleate in the presence of a catalytic amount of cinchonine to form (s)-(−)-diisopropyl phenylthiosuccinate, which can be further converted to (R)-(+)-3,4-epoxy-1-butanol. • Regioselective and stereoselective 1,4-addition to alkenylidenecyclopropanes leading to endo- or cis-vinyl sulfide adducts, a key step in the synthesis of karahanaenone. • Diastereoselective addition to (S)-N-(α,β-unsaturated carbonyl)-γ-[(trityloxy)m |
| General description: | Thiophenol is an organosulfur compound used as an intermediate to produce polymers. |
| Packaging: | 1 kg in Sure/Seal™ |
| Packaging: | 100, 500 g in Sure/Seal™ |
| Symbol |     GHS02,GHS06,GHS08,GHS09 |
| Signal word | Danger |
| Hazard statements | H226 - H300 + H310 + H330 - H315 - H319 - H335 - H361 - H372 - H410 |
| Precautionary statements | P210 - P273 - P280 - P303 + P361 + P353 - P304 + P340 + P310 - P305 + P351 + P338 |
| Hazard Codes | T+ |
| Risk Statements | 10-24/25-26-41 |
| Safety Statements | 23-26-28-36/37/39-45 |
| RIDADR | UN 2337 3(6.1) / PGI |
| WGK Germany | WGK 3 |
| Flash Point(F) | 122.0 °F - closed cup |
| Flash Point(C) | 50 °C - closed cup |
| Purity | 97% |
| bp | 169 °C (lit.) |
| mp | −15 °C (lit.) |
| Density | 1.073 g/mL at 25 °C (lit.) |
| Refractive Index | n |
| UNSPSC | 12352100 |