Product Number: 2274422
CAS Registry Number: 2274-42-2
Name:
Acetonitrile, 2-(methylsulfonyl)-
Acetonitrile, (methylsulfonyl)- (7CI,8CI,9CI); (Methylsulfonyl)acetonitrile; Methanesulfonylacetonitrile; NSC 207832
Chemical Formula: C3H5NO2S
Exact Mass: 119.00
Molecular Weight: 119.14
m/z: 119.00 (100.0%), 121.00 (4.5%), 120.01 (3.4%), 120.00 (1.2%)
InChI: InChI=1S/C3H5NO2S/c1-7(5,6)3-2-4/h3H2,1H3
InChIKey: FOTRKCAZUSJCQD-UHFFFAOYSA-N
Canonical SMILES : CS(=O)(=O)CC#N
| Thermal Properties |
Value |
Condition |
Note |
| Melting Point |
85-86 °C |
|
(7)CAS |
| Melting Point |
83.5-84.5 °C |
|
(8)CAS |
| Melting Point |
82-83 °C |
|
(4)CAS |
| Melting Point |
80.5-81.5 °C |
|
(5)IC |
|
- (1) AIST: Integrated Spectral Database System of Organic Compounds. (Data were obtained from the National Institute of Advanced Industrial Science and Technology (Japan))
- (2) BIORAD: Copyright Bio-Rad Laboratories. All Rights Reserved.
- (3) WSS: Spectral data were obtained from Wiley Subscription Services, Inc. (US)
- (4) Yang, Chuanbo; Green Chemistry 2009, V11(9), P1401-1405 CAPLUS
- (5) Bordwell, Frederick G.; Journal of Organic Chemistry 1982, V47(13), P2504-10 CAPLUS
- (6) BIORAD: Infrared spectral data from the Bio-Rad/Sadtler IR Data Collection was obtained from Bio-Rad Laboratories, Philadelphia, PA (US). Copyright © Bio-Rad Laboratories. All Rights Reserved.
- (7) Carboni, Rudolph A.; US 3166582 1965 CAPLUS
- (8) Dijkstra, R.; Recueil des Travaux Chimiques des Pays-Bas et de la Belgique 1954, V73, P569-74 CAPLUS
|
.gif)