HCID2771785

1-Bromo-3-(isocyano(tosyl)methyl)benzene

1-bromo-3-[isocyano-(4-methylphenyl)sulfonylmethyl]benzene

C15H12BrNO2S350.2 g/molCAS 655256-70-5

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IDENTITY

结构与身份

标准 SMILES: [C-]#[N+]C(c1cccc(Br)c1)S(=O)(=O)c1ccc(C)cc1
InChIKey: DVWQTDDROHVAFJ-UHFFFAOYSA-N
分子式: C15H12BrNO2S
平均分子量: 350.2 g/mol
单同位素质量: 348.97721

COMPUTED

结构计算性质

已同步

XLogP: 3.7
极性表面积: 46.9 Å²
氢键供体: 0
氢键受体: 3
可旋转键: 3
重原子: 20
形式电荷: 0
复杂度: 468

ALIASES

名称与别名

共 21 条

655256-70-51-bromo-3-(isocyano(tosyl)methyl)benzene3-BROMO-1-[ISOCYANO-(TOLUENE-4-SULFONYL)-METHYL]-BENZENE3-Bromo-1-[isocyano-(toluene-4-sulfonyl)methyl]benzenea-Tosyl-(3-bromobenzyl) isocyanideMFCD04114783a-Tosyl-(3-bromobenzyl)isocyanide1-bromo-3-[isocyano-(4-methylphenyl)sulfonylmethyl]benzeneSCHEMBL5712721-Bromo-3-[isocyano(4-methylbenzenesulfonyl)methyl]benzeneDTXSID50378084DVWQTDDROHVAFJ-UHFFFAOYSA-NAKOS005257436AB18977AS-40496DB-073633F2406421-bromo-3-[isocyano(p-tolylsulfonyl)methyl]benzene(3-Bromophenyl)(isocyano)methyl 4-methylphenyl sulfone1-Bromo-3-[isocyano(4-methylbenzene-1-sulfonyl)methyl]benzene

REACTIONS