乙酸壬酯

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货号 (SKU) 包装规格 是否现货 价格 数量
N464382-1kg
1kg 期货 Stock Image
N464382-4kg
4kg 期货 Stock Image

基本描述

英文别名 1-Acetoxynonane | SCHEMBL115437 | Nonyl alcohol, acetate | CHEBI:87511 | A0041 | DTXCID2027123 | GJQIMXVRFNLMTB-UHFFFAOYSA-N | Acetate C-9 | Acetic acid, nonyl ester | NCGC00256685-01 | Nonyl alcohol, acetate (6CI) | AI3-11583 | CS-0334128 | FT-0621754 |
规格或纯度 FCC, ≥97%
英文名称 Nonyl acetate
产品介绍


Description

Nonyl acetate is one of the key volatile flavor compounds of citrus fruits, mainly orange and lemon.

AI解读

关联靶点(其它种属)

Bursaphelenchus xylophilus (372 活性数据)
活性类型 Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID

作用机制

作用机制 Action Type target ID Target Name Target Type Target Organism Binding Site Name 参考文献

名称和识别符

分子类型 小分子
IUPAC Name nonyl acetate
INCHI InChI=1S/C11H22O2/c1-3-4-5-6-7-8-9-10-13-11(2)12/h3-10H2,1-2H3
InChi Key GJQIMXVRFNLMTB-UHFFFAOYSA-N
Canonical SMILES CCCCCCCCCOC(=O)C
Isomeric SMILES CCCCCCCCCOC(=O)C
RTECS AJ1382500
PubChem CID 8918
分子量 186.3
Reaxy-Rn 1759352

化学和物理性质

密度 0.864g/mL at 25°C (lit.)
折光率 1.42
闪点(℉) 108°C(lit.)
闪点(℃) 108°C(lit.)
沸点 228 °C
分子量 186.290 g/mol
XLogP3 4.000
氢键供体数Hydrogen Bond Donor Count 0
氢键受体数Hydrogen Bond Acceptor Count 2
可旋转键计数Rotatable Bond Count 9
精确质量Exact Mass 186.162 Da
单同位素质量Monoisotopic Mass 186.162 Da
拓扑极表面积Topological Polar Surface Area 26.300 Ų
重原子数Heavy Atom Count 13
形式电荷Formal Charge 0
复杂度Complexity 121.000
同位素原子数Isotope Atom Count 0
定义的原子立体中心计数Defined Atom Stereocenter Count 0
未定义的原子立体中心计数Undefined Atom Stereocenter Count 0
定义的键立体中心计数Defined Bond Stereocenter Count 0
未定义的键立体中心计数Undefined Bond Stereocenter Count 0
所有立体化学键的总数The total count of all stereochemical bonds 0
共价键合单元计数Covalently-Bonded Unit Count 1

安全和危险性(GHS)

RTECS AJ1382500
Reaxy-Rn 1759352
Merck Index 6678

技术规格说明书

质检证书(CoA,COO,BSE/TSE 和分析图谱)

C of A & Other Certificates(BSE/TSE, COO):
输入批号以搜索分析图谱:

此产品的引用文献

1. Xiong Xingyao, Gou Junbo, Liao Qinggang, Li Yanlin, Zhou Qian, Bi Guiqi, Li Chong, Du Ran, Wang Xiaotong, Sun Tianshu, Guo Lvjun, Liang Haifei, Lu Pengjun, Wu Yaoyao, Zhang Zhonghua, Ro Dae-Kyun, Shang Yi, Huang Sanwen, Yan Jianbin.  (2021)  The Taxus genome provides insights into paclitaxel biosynthesis.  Nature Plants,  (8): (1026-1036).  [PMID:34267359] [10.1038/s41477-021-00963-5]

参考文献

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