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桃醛

CAS 104-67-6C11H20O2MW 184.27主营产品

桃醛(CAS 104-67-6):分子式 C11H20O2、分子量 184.27。

产品概览

CAS号104-67-6
分子式C11H20O2
分子量184.27
沸点297 °C
LogP3.3

技术档案

这个产品是什么

桃醛 是一种化工化合物,登记 CAS 号为 104-67-6,分子式 C11H20O2(分子量 184.27)。

识别信息

登记 CAS 号:104-67-6

其分子式 C11H20O2 由 11 个碳、20 个氢、2 个氧 组成。

别名/同义词:桃醛 · Gamma-Undecalactone · Peach aldehyde (γ-Undecalactone)

常见问题

桃醛 的 CAS 号是多少?

桃醛 的 CAS 登记号为 104-67-6。

桃醛 的分子式与分子量是多少?

分子式 C11H20O2,分子量 184.27。

桃醛 还有哪些别名?

别名/同义词:桃醛、Gamma-Undecalactone、Peach aldehyde (γ-Undecalactone)。

PubChem 公开数据

桃醛(CAS 104-67-6)的独立参考数据,整理自公开化学数据库。

各数据库的登记标识

CAS Registry Number104-67-6
PubChem CID7714
Molecular formulaC11H20O2
Molecular weight184.15 g/mol
IUPAC name5-heptyloxolan-2-one
InChIKeyPHXATPHONSXBIL-UHFFFAOYSA-N
UNII (FDA)QB1T0AG2YL
ChEBI IDCHEBI:89362
FEMA number3091
JECFA number233

计算分子描述符

Molecular Weight184.27
XLogP33.3
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count6
Exact Mass184.146329876
Monoisotopic Mass184.146329876
Topological Polar Surface Area26.3
Heavy Atom Count13

在册的理化数值

Boiling Point297 °C
Density0.942-0.945
Refractive Index1.448-1.453

在册的记载用途

    Used as repellent for cats and dogs, as insecticide/repellant for house flies, cockroaches, ants, biting flies, and mosquitoes, and as a mosquito larvicide for residential and large scale public health applications; [Reference #1] Used as flavoring agent or adjuvant; [FDA]Flavoring Agents -> JECFA Flavorings Index

    同义词与商品名

    Gamma-undecalactone; 104-67-6; Undecan-4-olide; 5-heptyloxolan-2-one; 2(3H)-Furanone, 5-heptyldihydro-; Persicol; Peach aldehyde; Peach lactone; 5-Heptyldihydro-2(3H)-furanone; 1,4-Undecanolide; gamma-Undecanolactone; Aldehyde C-14 peach; 1,4-Hendecanolide; 4-Hydroxyundecanoic acid lactone; gamma-Undecanolide; .gamma.-Undecalactone

    已收录的法规名录

    Regulatory & Food ContactEU Flavoring substances
    FDA Substance added to food: FLAVORING AGENT OR ADJUVANT
    Flavoring Agents
    FLAVOURING_AGENT: Flavouring Agent
    Apricot, Fruit
    JECFA ADI: 0-1.25 mg/kg bw (1967)
    GHS notification summary69.7% (1536 / 2205)

    GHS 危害分类

    GHS notification summary69.7% (1536 / 2205)
    Reported hazard statementsH411 (10.3%), H412 (19.3%), H401

    This chemical does not meet GHS hazard criteria for 69.7% (1536 of 2205) of all reports.

    H411 (10.3%): Toxic to aquatic life with long lasting effects [Hazardous to the aquatic environment, long-term hazard]

    公开数据库对它的描述

    Peach aldehyde (γ-Undecalactone) is identified by CAS 104-67-6, molecular formula C11H20O2 and molecular weight 184.15 g/mol. UNII QB1T0AG2YL; ChEBI 89362; InChIKey PHXATPHONSXBIL-UHFFFAOYSA-N. Boiling Point: 297 °C; Density: 0.942-0.945; Refractive Index: 1.448-1.453.

    物理形态与操作说明

    数据来源:PubChem / Wikidata;与随货 COA 不一致时以 COA 为准。

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