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Cas Database |
| Name |
Benzene, 1-[(1-isocyano-3-buten-1-yl)sulfonyl]-4-methyl- |
EINECS | N/A |
| CAS No. | 58379-85-4 | Density | N/A |
| PSA | 42.52000 | LogP | 2.90170 |
| Solubility | N/A | Melting Point |
N/A |
| Formula | C12H13NO2S | Boiling Point | N/A |
| Molecular Weight | 235.307 | Flash Point | N/A |
| Transport Information | N/A | Appearance | N/A |
| Safety | Risk Codes | N/A | |
| Molecular Structure |
|
Hazard Symbols | N/A |
| Synonyms |
Benzene,1-[(1-isocyano-3-butenyl)sulfonyl]-4-methyl- (9CI); |
Article Data | 3 |
Benzene, 1-[(1-isocyano-3-buten-1-yl)sulfonyl]-4-methyl- Specification
This chemical is called Benzene, 1-[(1-isocyano-3-buten-1-yl)sulfonyl]-4-methyl-, and its systematic name is 1-[(1-isocyanobut-3-en-1-yl)sulfonyl]-4-methylbenzene. With the molecular formula of C12H13NO2S, its molecular weight is 235.30. The CAS registry number of this chemical is 58379-85-4.
Other characteristics of the Benzene, 1-[(1-isocyano-3-buten-1-yl)sulfonyl]-4-methyl- can be summarised as followings: (1)#H bond acceptors: 3; (2)#H bond donors: 0; (3)#Freely Rotating Bonds: 4; (4)Polar Surface Area: 46.88 Å2.
You can still convert the following datas into molecular structure:
1.SMILES: O=S(=O)(c1ccc(C)cc1)C([N+]#[C-])CC=C
2.InChI: InChI=1/C12H13NO2S/c1-4-5-12(13-3)16(14,15)11-8-6-10(2)7-9-11/h4,6-9,12H,1,5H2,2H3
3.InChIKey: OEZHRMOVCQGFOJ-UHFFFAOYAD
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