A6636612
2-Phenylethyl isothiocyanate , 99% , 2257-09-2
Synonym(s):
2-Phenylethyl isothiocyanate;PEITC;Phenethyl isothiocyanate
CAS NO.：2257-09-2
Empirical Formula: C9H9NS
Molecular Weight: 163.24
MDL number: MFCD00004821
EINECS: 218-855-5
| Pack Size | Price | Stock | Quantity |
| 1g | RMB39.20 | In Stock |
|
| 5G | RMB136.80 | In Stock |
|
| 25G | RMB399.20 | In Stock |
|
| 100g | RMB1076.00 | In Stock |
|
| others | Enquire |
Update time: 2022-07-08
PRODUCT Properties
| Melting point: | 143～145℃ |
| Boiling point: | 75 °C0.25 mm Hg |
| Density | 1.094 g/mL at 25 °C(lit.) |
| refractive index | n |
| FEMA | 4014 | PHENETHYL ISOTHIOCYANATE |
| Flash point: | >230 °F |
| storage temp. | 2-8°C |
| solubility | DMF: 30 mg/ml,DMSO: 30 mg/ml,Ethanol: 30 mg/ml |
| form | Liquid |
| Specific Gravity | 1.09 |
| color | Clear colorless to yellow |
| Odor | at 0.01 % in propylene glycol. green horseradish gooseberry watercress |
| Odor Type | sulfurous |
| biological source | synthetic |
| Water Solubility | insoluble |
| Sensitive | Moisture Sensitive |
| Merck | 14,7226 |
| JECFA Number | 1563 |
| BRN | 2084162 |
| Cosmetics Ingredients Functions | PERFUMING |
| InChI | 1S/C9H9NS/c11-8-10-7-6-9-4-2-1-3-5-9/h1-5H,6-7H2 |
| InChIKey | IZJDOKYDEWTZSO-UHFFFAOYSA-N |
| SMILES | S=C=NCCc1ccccc1 |
| LogP | 3.47 |
| CAS DataBase Reference | 2257-09-2(CAS DataBase Reference) |
| NIST Chemistry Reference | Benzene, (2-isothiocyanatoethyl)-(2257-09-2) |
| EPA Substance Registry System | Benzene, (2-isothiocyanatoethyl)- (2257-09-2) |
Description and Uses
Phenethyl isothiocyanate is a naturally occurring isothiocyanate in cruciferous vegetables. Phenethyl isothiocyanate is a chemopreventive agent. It inhibits cancer cell growth by arresting the cell cycle and inducing apoptosis in various human cancer cell models.
Phenethyl isothiocyanate is an NNK-induced lung tumorigenesis inhibitor.
Safety
| Symbol(GHS) |   GHS07,GHS08 |
| Signal word | Danger |
| Hazard statements | H302+H312+H332-H315-H317-H319-H334-H335 |
| Precautionary statements | P261-P264-P280-P301+P312-P302+P352+P312-P305+P351+P338 |
| target organs | Respiratory system |
| PPE | Eyeshields, Faceshields, Gloves, type ABEK (EN14387) respirator filter |
| Hazard Codes | Xn |
| Risk Statements | 20/21/22-36/37/38-42-42/43 |
| Safety Statements | 23-26-36-36/37 |
| RIDADR | UN 2206 6.1/PG 3 |
| WGK Germany | 3 |
| RTECS | NX9115000 |
| F | 10-23 |
| TSCA | TSCA listed |
| HazardClass | 8 |
| PackingGroup | III |
| HS Code | 29309090 |
| Storage Class | 10 - Combustible liquids |
| Hazard Classifications | Acute Tox. 4 Dermal Acute Tox. 4 Inhalation Acute Tox. 4 Oral Eye Irrit. 2 Resp. Sens. 1 Skin Irrit. 2 Skin Sens. 1 STOT SE 3 |
| Toxicity | LD50 in mice (mg/kg): 700 orally; 150 s.c.; 50 i.v. (Lichtenstein) |
