Allyl sulfide
SIAL/40647 - analytical standard
Synonym: 3,3′-Thiobis-1-propene; Diallyl sulfide; NSC 20947
CAS Number: 592-88-1
Empirical Formula (Hill Notation): C6H10S
Molecular Weight: 114.21
EC Number: 209-775-1
MDL Number: MFCD00008658
Linear Formula: (CH2=CHCH2)2S
Product Type: Chemical
| assay | ≥97.0% (GC) |
| bp | 138 °C (lit.) |
| density | 0.887 g/mL at 25 °C (lit.) |
| format | neat |
| grade | analytical standard |
| impurities | ≤0.5% water |
| InChI | 1S/C6H10S/c1-3-5-7-6-4-2/ |
| InChI key | UBJVUCKUDDKUJF-UHFFFAOYSA |
| mp | −83 °C (lit.) |
| Quality Level | 100  |
| refractive index | n |
| shelf life | limited shelf life, expiry date on the label |
| SMILES string | C=CCSCC=C |
| storage temp. | 2-8°C |
| technique(s) | gas chromatography (GC): suitable |
| HPLC: suitable | |
| vapor density | 3.9 (vs air) |
| vapor pressure | 7 mmHg ( 20 °C) |
| Application: | Refer to the product′s Certificate of Analysis for more information on a suitable instrument technique. Contact Technical Service for further support. |
| Biochem/physiol Actions: | Organosulfur compound from garlic that inhibits chemically-induced carcinogenesis in experimental animals. Competitive inhibitor of Cytochrome P450 2E1 (CYP2E1) that, in turn, blocks the activation of several chemcal carcinogens. |
| Symbol |  GHS02 |
| Signal word | Warning |
| Hazard statements | H226 |
| Precautionary statements | P210 - P370 + P378 |
| Hazard Codes | Xi |
| Risk Statements | 10-36/37/38 |
| Safety Statements | 26-36 |
| RIDADR | UN 1993C 3 / PGIII |
| WGK Germany | WGK 2 |
| Flash Point(F) | 114.8 °F - closed cup |
| Flash Point(C) | 46 °C - closed cup |
| Purity | ≥97.0% (GC) |
| bp | 138 °C (lit.) |
| mp | −83 °C (lit.) |
| Density | 0.887 g/mL at 25 °C (lit.) |
| Refractive Index | n |
| Storage Temp. | 2-8°C |
| UNSPSC | 85151701 |