| Identification | More | [Name]
Benzyl thiocyanate | [CAS]
3012-37-1 | [Synonyms]
2-Thiocyanatotoluene
BENZYL RHODANIDE
BENZYL THIOCYANATE
LABOTEST-BB LT00053217
THIOCYANIC ACID BENZYL ESTER
alpha-Thiocyanatotoluene
Benzylthiocyanide
Solvat 14
solvat14
Thiocyanic acid, phenylmethyl ester
Thiocyanicacid,phenylmethylester
Toluene, alpha-thiocyanato-
Tropeolin
BENZYL THIOCYANATE 98% MIN
Benzyl Thiocyanate, 94+%
BENZYL THIOCYANATE(SG)
Beazyl thiocyanate
Benzyl thiocyanate, 98+%
a-Thiocyanatotoluene
Benzylrhodonid | [EINECS(EC#)]
221-144-2 | [Molecular Formula]
C8H7NS | [MDL Number]
MFCD00001832 | [Molecular Weight]
149.21 | [MOL File]
3012-37-1.mol |
| Chemical Properties | Back Directory | [Appearance]
ALMOST WHITE TO YELLOW CRYSTALS OR CRYST. POWDER | [Melting point ]
39-41 °C (lit.)
39-41 °C | [Boiling point ]
230-235 °C (lit.) | [density ]
1.32 | [refractive index ]
1.6000 (estimate) | [Fp ]
>230 °F
| [storage temp. ]
2-8°C
| [solubility ]
diethyl ether: soluble0.5g/10 mL, clear to very faintly turbid, colorless to almost colorless | [form ]
Solid | [color ]
Orange-red crystals or solid | [Water Solubility ]
insoluble | [Sensitive ]
Moisture Sensitive | [BRN ]
1859726 | [InChI]
1S/C8H7NS/c9-7-10-6-8-4-2-1-3-5-8/h1-5H,6H2 | [InChIKey]
ABNDFSOIUFLJAH-UHFFFAOYSA-N | [SMILES]
N#CSCc1ccccc1 | [CAS DataBase Reference]
3012-37-1(CAS DataBase Reference) | [NIST Chemistry Reference]
Thiocyanic acid benzyl ester(3012-37-1) | [EPA Substance Registry System]
3012-37-1(EPA Substance) |
| Safety Data | Back Directory | [Symbol(GHS) ]
GHS07 | [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 ]
R20/21/22:Harmful by inhalation, in contact with skin and if swallowed .
R32:Contact with acids liberates very toxic gas. | [Safety Statements ]
S13:Keep away from food, drink and animal feeding stuffs .
S36/37:Wear suitable protective clothing and gloves . | [RIDADR ]
UN 1759 8/PG 2
| [WGK Germany ]
3
| [RTECS ]
XK8155000
| [TSCA ]
Yes | [HazardClass ]
6.1 | [PackingGroup ]
III | [HS Code ]
29309070 | [Storage Class]
8A - Combustible corrosive hazardous materials | [Hazard Classifications]
Acute Tox. 4 Dermal
Acute Tox. 4 Inhalation
Acute Tox. 4 Oral
Aquatic Chronic 3 | [Toxicity]
LDLo ipr-rat: 40 mg/kg ARZNAD 16,870,66ipr-mus LD50:17 mg/kg PCBPBS 2,95,72scu-mus LD50:100 mg/kg JJPAAZ 3,99,54 |
| Hazard Information | Back Directory | [Hazard]
Strong irritant to skin, tissue. Moderate fire hazard. | [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. | [Chemical Properties]
ALMOST WHITE TO YELLOW CRYSTALS OR CRYST. POWDER | [Uses]
Benzyl Thiocyanate is found to increase the protein production of Streptomyces aureofaciens. Inhibits methylazoxymethanol acetate-induced intestinal carcinogenesis and reduces unscheduled DNA synthesi
s for some genotoxic carcinogens in rats. | [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. | [Definition]
ChEBI: Benzyl thiocyanate is a member of thiocyanates. | [Synthesis Reference(s)]
Synthesis, p. 184, 1977
Tetrahedron Letters, 18, p. 4417, 1977 DOI: 10.1016/S0040-4039(01)83524-3 | [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. | [Safety Profile]
Poison by subcutaneous andintraperitoneal routes. Whenheated to decomposition it emits very toxic fumes ofNOx, SOx, and CN??. | [Purification Methods]
Crystallise the thiocyanate from EtOH or aqueous EtOH. [Beilstein 6 H 460, 6 IV 2680.] |
|
| Company Name: |
Alfa Aesar
|
| Telephone: |
400-6106006 |
| Website: |
http://chemicals.thermofisher.cn |
| Company Name: |
Energy Chemical
|
| Telephone: |
400-0056266 |
| Website: |
www.energy-chemical.com |
| Company Name: |
Maya High Purity Chemicals
|
| Telephone: |
+86 (573) 82222445 (0)18006601000 452520369 |
| Website: |
www.chemicalbook.com/ShowSupplierProductsList15221/0_EN.htm |
| Company Name: |
Credit-Chem Co., Ltd.
|
| Telephone: |
400-821-5857 021-64326257 |
| Website: |
www.chemicalbook.com/ShowSupplierProductsList12867/0_EN.htm |
| Company Name: |
Sigma-Aldrich
|
| Telephone: |
021-61415566 800-8193336 |
| Website: |
https://www.sigmaaldrich.cn |
|