81431-98-3
81431-98-3 structure
- Name: 2-CYANOPHENYL ISOTHIOCYANATE
- Chemical Name: 2-isothiocyanatobenzonitrile
- CAS Number: 81431-98-3
- Molecular Formula: C8H4N2S
- Molecular Weight: 160.19600
- Create Date: 2018-09-16 12:50:28
- Modify Date: 2024-01-03 09:21:07
| Name | 2-isothiocyanatobenzonitrile |
|---|---|
| Synonyms |
2-isothiocyanatoobenzonitrile
1-cyano-2-isothiocyanatobenzene 2-Cyanophenyl isothiocyanate Benzonitrile,2-isothiocyanato 2-isothiocyanatobenzenecarbonitrile |
| Density | 1.12g/cm3 |
|---|---|
| Boiling Point | 325.5ºC at 760mmHg |
| Melting Point | 119ºC |
| Molecular Formula | C8H4N2S |
| Molecular Weight | 160.19600 |
| Flash Point | 150.7ºC |
| Exact Mass | 160.01000 |
| PSA | 68.24000 |
| LogP | 2.29258 |
| Index of Refraction | 1.604 |
| Risk Phrases | 20/21/22-36/37/38 |
|---|---|
| Safety Phrases | 26-36/37/39 |
| RIDADR | UN 2811 |
| HS Code | 2930909090 |
|
~82%
81431-98-3 |
| Literature: Calestani, Gianluca; Capella, Laura; Leardini, Rino; Minozzi, Matteo; Nanni, Daniele; Papa, Romina; Zanardi, Giuseppe Tetrahedron, 2001 , vol. 57, # 33 p. 7221 - 7233 |
|
~56%
81431-98-3 |
| Literature: Besson, Thierry; Guillard, Jerome; Rees, Charles W.; Therisod, Michel Chemical Communications, 1997 , # 9 p. 881 - 882 Title/Abstract Full Text View citing articles Show Details Besson, Thierry; Guillard, Jerome; Rees, Charles W.; Thiery, Valerie Journal of the Chemical Society - Perkin Transactions 1, 1998 , # 5 p. 889 - 892 |
|
~77%
81431-98-3 |
| Literature: Pfeiffer; Pazdera; Hetzheim; Mucke Pharmazie, 1995 , vol. 50, # 1 p. 21 - 25 |
|
~%
81431-98-3 |
| Literature: Journal of the Chemical Society - Perkin Transactions 1, , # 5 p. 889 - 892 |
|
~%
81431-98-3 |
| Literature: Spectrochimica Acta - Part A: Molecular and Biomolecular Spectroscopy, , vol. 67, # 3-4 p. 1055 - 1059 |
| Precursor 4 | |
|---|---|
| DownStream 5 | |
![2-(2-Furanyl)-[1,2,4]triazolo[1,5-c]quinazoline-5-amine structure](https://www.chemsrc.com/caspic/364/104615-28-3.png)
![[1,3]benzothiazolo[2,3-b]quinazolin-12-one structure](https://www.chemsrc.com/caspic/048/22721-43-3.png)
![2-(4-pyridyl)-1,2,4-triazolo[1,5-c]quinazoline-5(6H)-thione structure](https://www.chemsrc.com/caspic/363/443673-90-3.png)
| HS Code | 2930909090 |
|---|---|
| Summary | 2930909090. other organo-sulphur compounds. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:30.0% |