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2,5,9-Trimethyl-4,9-decadienal | 32803-39-7

中文名称
——
中文别名
——
英文名称
2,5,9-Trimethyl-4,9-decadienal
英文别名
(4E)-2,5,9-trimethyldeca-4,9-dienal
2,5,9-Trimethyl-4,9-decadienal化学式
CAS
32803-39-7
化学式
C13H22O
mdl
——
分子量
194.31
InChiKey
MINJGYRWHNAENM-XYOKQWHBSA-N
BEILSTEIN
——
EINECS
——
  • 物化性质
  • 计算性质
  • ADMET
  • 安全信息
  • SDS
  • 制备方法与用途
  • 上下游信息
  • 反应信息
  • 文献信息
  • 表征谱图
  • 同类化合物
  • 相关功能分类
  • 相关结构分类

物化性质

  • 沸点:
    278.3±19.0 °C(Predicted)
  • 密度:
    0.848±0.06 g/cm3(Predicted)
  • LogP:
    4.310 (est)
  • 保留指数:
    1423

计算性质

  • 辛醇/水分配系数(LogP):
    4.4
  • 重原子数:
    14
  • 可旋转键数:
    7
  • 环数:
    0.0
  • sp3杂化的碳原子比例:
    0.62
  • 拓扑面积:
    17.1
  • 氢给体数:
    0
  • 氢受体数:
    1

文献信息

  • Novel Fragrance Compounds
    申请人:Fortineau Anne Dominique
    公开号:US20100069287A1
    公开(公告)日:2010-03-18
    A compound having the structure (A) where R1 is C1 to C5 alkyl, and R2 to R5 are independently selected from H and methyl, having a strong odour and for use as a perfumery ingredient, particularly in Muguet accords/fragrances, is provided.
    提供一种具有结构(A)的化合物,其中R1为C1至C5烷基,R2至R5分别独立选择H和甲基,具有强烈的气味,用作香料成分,特别是在鸢尾花香调/香水中。
  • Fragrance Compositions and Compounds
    申请人:Dang Hai-Shan
    公开号:US20100132249A1
    公开(公告)日:2010-06-03
    A perfume composition including at least one compound having the formula: wherein p, q and r are independently selected from 0 and 1, p+q+r being from 0-3 and X1 is saturated or unsaturated, such that: (a) when p+q+r=0, R1, R2 and R12 are Me; R3-5 and R9-11 are H; (b) when p+q+r=1, R1 and R12 are independently selected from H, Me and Et; R2 is selected from H and C 1 -C 4 alkyl; R3-5 and R9 are independently selected from H and methyl; and R8 and R10 are H; (c) when p+q+r=2, R1 and R2 are selected from H and C 1 -C 4 alkyl, R3 and R9-12 are independently selected from H and methyl: R4-5 are H, or R4 and R5 together form a methylene group; and R6-7 are H; (d) when p+q+r=3, R1, R2 and R12 are Me; and R3-11 are H.
    一种香水组合物,包括至少一种具有以下式子的化合物:其中p、q和r分别独立地选择0和1,p+q+r为0-3,X1是饱和或不饱和的,使得: (a)当p+q+r=0时,R1、R2和R12为Me;R3-5和R9-11为H; (b)当p+q+r=1时,R1和R12独立选择自H、Me和Et;R2选择自H和C1-C4烷基;R3-5和R9独立选择自H和甲基;R8和R10为H; (c)当p+q+r=2时,R1和R2选择自H和C1-C4烷基,R3和R9-12独立选择自H和甲基:R4-5为H,或R4和R5共同形成亚甲基基团;R6-7为H; (d)当p+q+r=3时,R1、R2和R12为Me;R3-11为H。
  • Fragrance compositions and compounds
    申请人:Givaudan Nederland Services B.V.
    公开号:EP2514812A2
    公开(公告)日:2012-10-24
    The compound 4-[(1,5-dimethylhexyl)-oxy]butanal and its use in fragrance applications. The compound is particularly substantive and confers a muguet (lily of the valley9 fragrance note.
    化合物 4-[(1,5-二甲基己基)-氧基]丁醛及其在香料中的应用。 该化合物具有特别的香味,并能带来木格埃(铃兰)9 的香味。
  • PROCEDE DE PARFUMAGE DE TEXTILES
    申请人:FIRMENICH SA
    公开号:EP0668904A1
    公开(公告)日:1995-08-30
  • MODIFYING OR ENHANCING A FLAVOR OF FOOD AND BEVERAGE PRODUCTS
    申请人:Tate & Lyle Ingredients Americas LLC
    公开号:EP3554275A1
    公开(公告)日:2019-10-23
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