| Identification | More | [Name]
3-CYANOPHENYL ISOTHIOCYANATE | [CAS]
3125-78-8 | [Synonyms]
3-CYANOPHENYL ISOTHIOCYANATE | [Molecular Formula]
C8H4N2S | [MDL Number]
MFCD00041070 | [Molecular Weight]
160.2 | [MOL File]
3125-78-8.mol |
| Chemical Properties | Back Directory | [Melting point ]
64-66 °C(lit.) | [Boiling point ]
303.1±25.0 °C(Predicted) | [density ]
1.2628 (rough estimate) | [refractive index ]
1.6000 (estimate) | [storage temp. ]
Keep Cold | [Water Solubility ]
102.7mg/L(25 ºC) | [Sensitive ]
Moisture Sensitive | [BRN ]
2803099 | [InChI]
1S/C8H4N2S/c9-5-7-2-1-3-8(4-7)10-6-11/h1-4H | [InChIKey]
UXCYPHCFQAFVFH-UHFFFAOYSA-N | [SMILES]
S=C=Nc1cccc(c1)C#N | [CAS DataBase Reference]
3125-78-8(CAS DataBase Reference) |
| Safety Data | Back Directory | [Hazard Codes ]
C,T | [Risk Statements ]
R20/21/22:Harmful by inhalation, in contact with skin and if swallowed .
R34:Causes burns.
R42:May cause sensitization by inhalation. | [Safety Statements ]
S22:Do not breathe dust .
S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S36/37/39:Wear suitable protective clothing, gloves and eye/face protection .
S45:In case of accident or if you feel unwell, seek medical advice immediately (show label where possible) . | [RIDADR ]
UN 1759 8/PG 3
| [WGK Germany ]
3
| [HazardClass ]
8 | [PackingGroup ]
III | [HS Code ]
29309090 | [Storage Class]
8A - Combustible corrosive hazardous materials | [Hazard Classifications]
Acute Tox. 4 Oral
Resp. Sens. 1
Skin Corr. 1B
Skin Sens. 1 |
| Hazard Information | Back Directory | [Uses]
3-Cyanophenyl isothiocyanate may be used in the synthesis of ((3-cyanophenyl)amino)((2-phenylethyl)amino)methane- 1-thione and N-((3-cyanophenyl)carbamothioyl)benzimidamide. | [General Description]
3-Cyanophenyl isothiocyanate, also known as 3-isothiocyanatobenzonitrile, is an organic building block containing an isocyanate group Its freezing point, density and refractive index have been reported. |
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| Company Name: |
J & K SCIENTIFIC LTD.
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| Telephone: |
18210857532 18210857532 |
| Website: |
https://www.jkchemical.com |
| Company Name: |
Alfa Aesar
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400-6106006 |
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http://chemicals.thermofisher.cn |
| Company Name: |
Energy Chemical
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| Telephone: |
400-0056266 |
| Website: |
www.energy-chemical.com |
| Company Name: |
Credit-Chem Co., Ltd.
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| Telephone: |
400-821-5857 021-64326257 |
| Website: |
www.chemicalbook.com/ShowSupplierProductsList12867/0_EN.htm |
| Company Name: |
Sigma-Aldrich
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| Telephone: |
021-61415566 800-8193336 |
| Website: |
https://www.sigmaaldrich.cn |
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