Synonym: Benzyl rhodanide
CAS Number: 3012-37-1
Empirical Formula (Hill Notation): C8H7NS
Molecular Weight: 149.21
EC Number: 221-144-2
MDL Number: MFCD00001832
Linear Formula: C6H5CH2SCN
Product Type: Chemical
assay | ≥95.0% (GC) |
bp | 230-235 °C (lit.) |
form | solid |
functional group | phenyl |
thiocyanate | |
thioether | |
InChI | 1S/C8H7NS/c9-7-10-6-8-4-2 |
InChI key | ABNDFSOIUFLJAH-UHFFFAOYSA |
mp | 39-41 °C |
39-41 °C (lit.) | |
Quality Level | 100 ![]() |
SMILES string | N#CSCc1ccccc1 |
solubility | diethyl ether: soluble 0.5 g/10 mL, clear to very faintly turbid, colorless to almost colorless |
storage temp. | 2-8°C |
Application: | Benzyl thiocyanate was used to study the effects of various dietary compounds on the α-hydroxylation of N-nitrosopyrrolidine in male F344 rats in vitro. |
General description: | Benzyl thiocyanate undergoes regioselective bond dissociation during its electrochemical reduction in acetonitrile at an inert electrode. It is added to stimulate the chlortetracycline biosynthesis during industrial fermentations. It undergoes biotransformation into dibenzyl disulphide by Streptomyces aureofaciens. |
Packaging: | 100 g in glass bottle |
Symbol | ![]() |
Signal word | Warning |
Hazard statements | H302 + H312 + H332 - H412 |
Precautionary statements | P273 - P280 - P301 + P312 + P330 - P302 + P352 + P312 - P304 + P340 + P312 |
Hazard Codes | Xn |
Risk Statements | 20/21/22-32 |
Safety Statements | 13-36/37 |
RIDADR | UN 1759 8 / PGII |
WGK Germany | WGK 3 |
Flash Point(F) | 230.0 °F |
Flash Point(C) | 110 °C |
Supplemental Hazard Statements | EUH032 |
Purity | ≥95.0% (GC) |
bp | 230-235 °C (lit.) |
mp | 39-41 °C (lit.); 39-41 °C |
Storage Temp. | 2-8°C |
UNSPSC | 12352100 |
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