4-(4-甲基戊基)环己烷-1-甲醛 | 76489-66-2

• 分子结构分类: 有机化合物 - 有机氧化合物 - 有机氧化物
• 中文名称: 4-(4-甲基戊基)环己烷-1-甲醛
• 英文名称: 4-isohexyl-cyclohexanecarbaldehyde
• 英文别名: 4-Isohexyl-cyclohexancarbaldehyd；4-(4-methylpentyl)cyclohexanecarbaldehyde；4-(4-methylpentyl)cyclohexane-1-carbaldehyde
• CAS: 76489-66-2
• 化学式: C₁₃H₂₄O
• 分子量: 196.333
• InChiKey: IFDRPWDMFYPZLB-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  4.5
• 重原子数：
  14
• 可旋转键数：
  5
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.92
• 拓扑面积：
  17.1
• 氢给体数：
  0
• 氢受体数：
  1

安全信息

• 海关编码：
  2912299000

反应信息

• 作为反应物：
  描述：

  4-(4-甲基戊基)环己烷-1-甲醛 在 chromium(VI) oxide 、 硫酸 、 丙酮 作用下， 生成 4-isohexyl-cyclohexanecarboxylic acid
  参考文献：
  名称：

  Mousseron-Canet; Mousseron, Bulletin de la Societe Chimique de France, 1956, p. 391,395

  摘要：

  DOI：
• 作为产物：
  描述：

  alkaline earth salt of/the/ methylsulfuric acid 在 盐酸 、 水 作用下， 生成 4-(4-甲基戊基)环己烷-1-甲醛
  参考文献：
  名称：

  Mousseron-Canet; Mousseron, Bulletin de la Societe Chimique de France, 1956, p. 391,395

  摘要：

  DOI：

文献信息

• NOVEL FRAGRANCES WITH ROSE SCENT
  申请人：SYMRISE AG

  公开号：US20210324300A1

  公开（公告）日：2021-10-21

  The present invention primarily concerns the use of compounds of the following formula (I) wherein X represents an oxygen atom, a —CHO, an —OH, or a —CH 2 OH group, a single bond or a double bond is present at the respective location of one of the dotted lines, at least one double bond is present when X is an OH group, and the 3-isopentyl or 3-isopent-2-enyl residue is connected to the ring in the ortho, meta, or para position to the X group, as perfuming and/or flavouring agents. The invention further relates to fragrance and flavour compositions containing one or more of these compounds, perfumed or flavoured articles comprising one or more of these compounds and corresponding processes for imparting, modifying and/or enhancing certain odour notes.
• [EN] NITRILE COMPOUNDS AS PERFUMING INGREDIENTS<br/>[FR] COMPOSÉS NITRILIQUES INGRÉDIENTS DE PARFUMS
  申请人：FIRMENICH & CIE

  公开号：WO2011033410A1

  公开（公告）日：2011-03-24

  The present invention relates to the field of perfumery. More particularly, it concerns some nitrile derivatives of formula (I) in the form of any one of its stereoisomers or a mixture thereof, and wherein n represents 0 or 1, and R represents a C3-7 linear, branched or cyclic alkyl or alkenyl group optionally comprising an oxygen atom. Said compounds are useful perfuming ingredients capable of imparting nitrile/citrus notes. The present invention concerns also the compositions and the consumers' articles containing said nitrile derivatives.
• Mousseron-Canet; Mousseron, Bulletin de la Societe Chimique de France, 1956, p. 391,395
  作者：Mousseron-Canet、Mousseron

  DOI：——

  日期：——