p-Tolyl isothiocyanate
ALDRICH/253715 - 97%
Synonym: 4-Methylphenyl isothiocyanate
CAS Number: 622-59-3
Empirical Formula (Hill Notation): C8H7NS
Molecular Weight: 149.21
EC Number: 210-745-5
MDL Number: MFCD00004813
Linear Formula: CH3C6H4NCS
Product Type: Chemical
| assay | 97% |
| bp | 237 °C (lit.) |
| 62 °C/0.3 mmHg (lit.) | |
| form | solid |
| functional group | isothiocyanate |
| InChI | 1S/C8H7NS/c1-7-2-4-8(5-3- |
| InChI key | ABQKHKWXTUVKGF-UHFFFAOYSA |
| mp | 25-26 °C (lit.) |
| Quality Level | 200 ![]() |
| refractive index | n |
| SMILES string | Cc1ccc(cc1)N=C=S |
| Application: | p-Tolyl isothiocyanate has been used: • in the preparation of 6-[1-amino-3-(p-tolyl)-thiourea]-2-ethyl • as capping agent to cap the N-terminal ends of polypeptides |
| General description: | p-Tolyl isothiocyanate reacts with 6-hydroxy-2,4,5-triaminop |
| Packaging: | 5 g in glass bottle |
| Symbol | ![]() GHS07,GHS08 |
| Signal word | Danger |
| Hazard statements | H315 - H317 - H319 - H334 - H335 |
| Precautionary statements | P280 - P302 + P352 - P305 + P351 + P338 |
| Hazard Codes | Xn |
| Risk Statements | 36/37/38-42 |
| Safety Statements | 22-26-36 |
| RIDADR | UN 2811 6.1 / PGII |
| WGK Germany | WGK 3 |
| Flash Point(F) | 224.6 °F - closed cup |
| Flash Point(C) | 107 °C - closed cup |
| Purity | 97% |
| bp | 237 °C (lit.); 62 °C/0.3 mmHg (lit.) |
| mp | 25-26 °C (lit.) |
| Refractive Index | n |
| UNSPSC | 12352100 |



