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| CAS No.: | 36635-66-2 |
|---|---|
| Name: | (1-Phenyl-1-tosyl)methyl isocyanide |
| Article Data: | 10 |
| Molecular Structure: | |
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| Formula: | C15H13NO2S |
| Molecular Weight: | 271.34 |
| Synonyms: | a-(4-Tolylsulfonyl)benzylisocyanide;a-(p-Tolylsulfonyl)benzylisocyanide;a-Tosylbenzylisocyanide; |
| EINECS: | 200-258-5 |
| Melting Point: | 106 °C(dec.) |
| Hazard Symbols: |
 Xi
|
| PSA: | 42.52000 |
| LogP: | 3.69830 |
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- Total:30 Page 1 of 1 1
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Specification
The (1-Phenyl-1-tosyl)methyl isocyanide, with the CAS registry number 36635-66-2, is also known as Isocyano(phenyl)methyl 4-methylphenyl sulfone. It belongs to the product category of Pharmacetical. This chemical's molecular formula is C15H13NO2S and molecular weight is 271.33. Its systematic name is called 1-{[isocyano(phenyl)methyl]sulfonyl}-4-methylbenzene. When you are using this chemical, please be cautious about it. This chemical may cause inflammation to the skin or other mucous membranes.
Physical properties of (1-Phenyl-1-tosyl)methyl isocyanide: (1)#H bond acceptors: 3; (2)#Freely Rotating Bonds: 3; (3)Polar Surface Area: 46.88 Å2.
You can still convert the following datas into molecular structure:
(1)SMILES: O=S(=O)(c1ccc(cc1)C)C([N+]#[C-])c2ccccc2
(2)InChI: InChI=1/C15H13NO2S/c1-12-8-10-14(11-9-12)19(17,18)15(16-2)13-6-4-3-5-7-13/h3-11,15H,1H3
(3)InChIKey: KIJCBVOPJSHLBI-UHFFFAOYAD