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安全信息

D7151

Sigma-Aldrich

1,7-二氧杂螺[5.5]十一烷

≥97%

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别名:
Olive-fly ketal
经验公式（希尔记法）:
C9H16O2
CAS号:
180-84-7
分子量:
156.22
EC 号:
205-870-7
MDL编号:
MFCD00011578
PubChem化学物质编号:
57654121
NACRES:
NA.22

检测方案

≥97%

形式

liquid

折射率

n20/D 1.464 (lit.)

bp

193 °C/750 mmHg (lit.)

密度

1.02 g/mL at 25 °C (lit.)

储存温度

2-8°C

SMILES string

C1CCC2(CCCCO2)OC1

InChI

1S/C9H16O2/c1-3-7-10-9(5-1)6-2-4-8-11-9/h1-8H2

InChI key

GBBVHDGKDQAEOT-UHFFFAOYSA-N

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相关类别

生化/生理作用

油橄榄实蝇 (Dacus oleae) 的信息素

储存分类代码

10 - Combustible liquids

WGK

WGK 3

闪点(°F)

147.2 °F - closed cup

闪点(°C)

64 °C - closed cup

法规信息

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N Rysanek et al.
Acta crystallographica. Section C, Crystal structure communications, 52 ( Pt 11), 2932-2936 (1996-11-15)
The complex beta-cyclodextrin-1,7-dioxaspiro[5,5]undecane nonahydrate, C42H70O35.C9H16O2.9H2O, belongs to the class of beta-cyclodextrin dimeric-type complexes. The racemic guest molecule is present in a disordered position. Both enantiomers are located in two different regions inside the channel formed by the host dimers.
Brett D Schwartz et al.
Organic letters, 7(6), 1173-1176 (2005-03-12)
[reaction: see text] A biosynthetic scheme rationalizing the formation of (+/-)-1,7-dioxaspiro[5.5]undecane (5) in the fruit fly species Bactrocera cacuminata and Bactrocera oleae (olive fruit fly) is presented. Incorporation studies with deuterium-labeled keto aldehyde (10), 1,5-nonanediol (11), and 1,5,9-nonanetriol (12), and
Abby Jones Weldon et al.
The Journal of organic chemistry, 71(24), 9212-9216 (2006-11-18)
The relative gas-phase energetics of several low-lying isomers of 1,7-dioxaspiro[5.5]undecane and 1,7,9-trioxadispiro[5.1.5.3]hexadecane have been calculated with second-order Mller-Plesset perturbation theory and basis sets as large as aug-cc-pVQZ. Relative energies in THF, dichloromethane, acetone, and DMSO have been estimated with corrections
Anat Levi-Zada et al.
Journal of chemical ecology, 38(8), 1036-1041 (2012-09-04)
The olive fruit fly, Bactrocera oleae (Diptera: Tephritidae), uses 1,7-dioxaspiro[5.5]undecane ("olean"), produced primarily by females, as a sex pheromone. We used sequential solid phase microextraction-gas chromatography mass spectrometry (SPME-GCMS) analysis to show that female olive flies release about 1000 ng
S Makedonopoulou et al.
Acta crystallographica. Section B, Structural science, 57(Pt 3), 399-409 (2001-05-25)
The enantiomers of racemic olive fly sex pheromone 1,7-dioxaspiro[5.5]undecane (1) have been isolated by crystallization with enantiospecific cyclodextrin hosts: (S)-(1) crystallizes with heptakis(2,3,6-tri-O-methyl)-beta-cyclodextrin (TMbetaCD) and (R)-(1) with hexakis(2,3,6-tri-O-methyl)-alpha-cyclodextrin (TMalphaCD). The crystal structure of TMbetaCD/(S)-(1) from synchrotron radiation data at 100
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