BENZYL ISOTHIOCYANATE 622-78-6 C8H7NS
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BENZYL ISOTHIOCYANATE Basic information |
Product Name: | BENZYL ISOTHIOCYANATE |
Synonyms: | (isothiocyanatomethyl)-benzen;(Isothiocyanatomethyl)benzene;AB 2;benzene,(isothiocyanatomethyl)-;Benzyl mustard oil;benzylmustardoil;Benzylsenfoel;isothiocyanatomethyl-Benzene |
CAS: | 622-78-6 |
MF: | C8H7NS |
MW: | 149.21 |
EINECS: | 210-753-9 |
Product Categories: | Aromatics;Intermediates & Fine Chemicals;Pharmaceuticals;Sulfur & Selenium Compounds;Allium cepa (Onion);Armoracia rusticana (Horseradish);Building Blocks;Chemical Synthesis;Nutrition Research;Organic Building Blocks;Phytochemicals by Plant (Food/Spice/Herb);Sulfur Compounds;Thiocyanates/Isothiocyanates;Inhibitors |
Mol File: | 622-78-6.mol |
BENZYL ISOTHIOCYANATE Chemical Properties |
Melting point | 41 °C |
Boiling point | 242-243 °C(lit.) |
density | 1.125 g/mL at 25 °C(lit.) |
refractive index |
n |
FEMA | 4428 | BENZYL ISOTHIOCYANATE |
Fp | >235 °F |
storage temp. | 2-8°C |
solubility | 0.1g/l |
form | Liquid |
Specific Gravity | 1.125 |
color | Clear yellow |
Water Solubility | Hydrolyzes in water. |
Sensitive | Moisture Sensitive |
JECFA Number | 1562 |
BRN | 386135 |
InChIKey | MDKCFLQDBWCQCV-UHFFFAOYSA-N |
CAS DataBase Reference | 622-78-6(CAS DataBase Reference) |
Safety Information |
Hazard Codes | Xn,C,T |
Risk Statements | 20/21/22-36/37/38-42/43 |
Safety Statements | 26-36/37/39 |
RIDADR | 2810 |
WGK Germany | 3 |
RTECS | NX8250000 |
F | 8-19-21 |
Hazard Note | Corrosive/Harmful/Store under nitrogen |
TSCA | T |
HazardClass | 8 |
PackingGroup | III |
HS Code | 29309090 |
BENZYL ISOTHIOCYANATE Usage And Synthesis |
Chemical Properties | clear yellow liquid |
Chemical Properties | Pale yellowish liquid; strong, penetrating aroma. |
Occurrence | Reported found in common cress, Lepidium sativum, nasturtium, and Tropaeolum majus. |
Uses | A novel medical application of isothiocyanate ester in treating various leukemia, with low toxicity, which includes benzyl isothiocyanate, phenylethyl isothiocyanate, allyl isothiocyanate, sulforaphane, and erucin. Benzyl isothiocyanate (BITC) inhibits the growth of human pancreatic cancer cells by inducing apoptosis. |
Uses | antineoplastic, antibacterial, antifungal |
Uses | Benzyl isothiocyanate has been used in the preparation of S-(N-benzylthiocarbamoyl)-L-glutathione and S-(N-benzylthiocarbamoyl)-L-cysteine. |
Aroma threshold values | Medium strength odor, watercress type; recommend smelling in a 1.0% solution or less. |
Hazard | Very irritant to tissues. |
BENZYL ISOTHIOCYANATE Preparation Products And Raw materials |
Preparation Products | Guanine |
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