1-ADAMANTYL ISOTHIOCYANATE
1-Adamantyl isothiocyanate
CAS: 4411-26-1
Molecular Formula: C11H15NS
1-ADAMANTYL ISOTHIOCYANATE - Names and Identifiers
| Name | 1-Adamantyl isothiocyanate |
| Synonyms | AKOS BC-0479 CHEMBRDG-BB 4013913 LABOTEST-BB LT00007840 1-ADAMANTYL ISOTHIOCYANATE 1-Adamantyl isothiocyanate 1-ISOTHIOCYANATO-ADAMANTANE Isothiocyanic acid 1-adamantyl estr tricyclo(3.3.1.13,7)dec-1-yl isocyanate 1-isothiocyanatotricyclo[3.3.1.1~3,7~]decane |
| CAS | 4411-26-1 |
| EINECS | 224-564-4 |
| InChI | InChI=1/C11H15NS/c13-7-12-11-4-8-1-9(5-11)3-10(2-8)6-11/h8-10H,1-6H2 |
| InChIKey | YPKFLUARLJRPQM-UHFFFAOYSA-N |
1-ADAMANTYL ISOTHIOCYANATE - Physico-chemical Properties
| Molecular Formula | C11H15NS |
| Molar Mass | 193.31 |
| Density | 1.35 |
| Melting Point | 166-168 °C (lit.) |
| Boling Point | 297.6°C at 760 mmHg |
| Flash Point | 138°C |
| Vapor Presure | 0.00237mmHg at 25°C |
| Storage Condition | Room Temprature |
| Refractive Index | 1.5500 (estimate) |
| MDL | MFCD00074736 |
1-ADAMANTYL ISOTHIOCYANATE - Risk and Safety
| Hazard Symbols | Xn - Harmful |
| Risk Codes | R20/21/22 - Harmful by inhalation, in contact with skin and if swallowed. R36/37/38 - Irritating to eyes, respiratory system and skin. |
| Safety Description | S26 - In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. S37/39 - Wear suitable gloves and eye/face protection |
| UN IDs | 2811 |
| WGK Germany | 3 |
| Hazard Class | 6.1(b) |
| Packing Group | III |
1-ADAMANTYL ISOTHIOCYANATE - Introduction
1-Adamantyl isothiocyanate(1-Adamantyl isothiocyanate) is an organic compound with the molecular formula C12H17NS and a relative molecular mass of 211.33g/mol. The following is a description of its nature, use, formulation and safety information:
Nature:
1. 1-Adamantyl isothiocyanate is a colorless to light yellow oily liquid with a special pungent odor.
2. Its density is about 1.02g/cm³, its melting point is -9°C, and its boiling point is 120-121°C.
3.1-Adamantyl isothiocyanate is soluble in organic solvents such as ethanol and dichloromethane without being soluble in water.
Use:
1. 1-Adamantyl isothiocyanate is commonly used as a reaction reagent in organic synthesis.
2. It can react with other compounds to generate new organic compounds for synthesis of coordination chemistry and drug research.
3.1-Adamantyl isothiocyanate can also be used as an intermediate for chemical dyes and optical brighteners.
Preparation Method:
1-Adamantyl isothiocyanate are generally obtained by reacting aminothiocyanic acid with 1-adamantanol under basic conditions. This reaction can be carried out at normal temperature, and usually requires heating and a reaction over a certain period of time.
Safety Information:
1. 1-Adamantyl isothiocyanate is an irritating chemical that irritates the eyes and skin on contact, so direct contact between skin and eyes should be avoided.
2. in use, should take appropriate laboratory safety measures, such as wearing gloves, protective glasses and laboratory outside operation.
3. The compound should also be stored in a dry, well-ventilated place, away from fire sources and oxidants, and avoid contact with moisture in the air to avoid aggravating instability.
4. 1-Adamantyl isothiocyanate must be kept away from children and can only be used by personnel who have received appropriate training and understanding of safe operating precautions.
Nature:
1. 1-Adamantyl isothiocyanate is a colorless to light yellow oily liquid with a special pungent odor.
2. Its density is about 1.02g/cm³, its melting point is -9°C, and its boiling point is 120-121°C.
3.1-Adamantyl isothiocyanate is soluble in organic solvents such as ethanol and dichloromethane without being soluble in water.
Use:
1. 1-Adamantyl isothiocyanate is commonly used as a reaction reagent in organic synthesis.
2. It can react with other compounds to generate new organic compounds for synthesis of coordination chemistry and drug research.
3.1-Adamantyl isothiocyanate can also be used as an intermediate for chemical dyes and optical brighteners.
Preparation Method:
1-Adamantyl isothiocyanate are generally obtained by reacting aminothiocyanic acid with 1-adamantanol under basic conditions. This reaction can be carried out at normal temperature, and usually requires heating and a reaction over a certain period of time.
Safety Information:
1. 1-Adamantyl isothiocyanate is an irritating chemical that irritates the eyes and skin on contact, so direct contact between skin and eyes should be avoided.
2. in use, should take appropriate laboratory safety measures, such as wearing gloves, protective glasses and laboratory outside operation.
3. The compound should also be stored in a dry, well-ventilated place, away from fire sources and oxidants, and avoid contact with moisture in the air to avoid aggravating instability.
4. 1-Adamantyl isothiocyanate must be kept away from children and can only be used by personnel who have received appropriate training and understanding of safe operating precautions.
Last Update：2024-04-09 02:00:46
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