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ALDEHYDE C-18

CAS 104-61-0C9H16O2MW 156.22

ALDEHYDE C-18(CAS 104-61-0):分子式 C9H16O2、分子量 156.22;类别 有机化学品。

规格参数

CAS号104-61-0
分子式C9H16O2
分子量156.22
沸点BP: 134 °C at 12 mm Hg
LogP2.2
类别Organic Chemicals

采购档案

这个产品是什么

ALDEHYDE C-18 是一种以碳骨架为基础的有机化合物,登记 CAS 号为 104-61-0,分子式 C9H16O2(分子量 156.22),归属于有机化学品大类化工原料。

识别信息

登记 CAS 号:104-61-0

其分子式 C9H16O2 由 9 个碳、16 个氢、2 个氧 组成。

别名/同义词:ALDEHYDE C-18 · Gamma-Nonalactone · Gamma-Nonanolactone

所属分类:有机化学品

常见问题

ALDEHYDE C-18 的 CAS 号是多少?

ALDEHYDE C-18 的 CAS 登记号为 104-61-0。

ALDEHYDE C-18 的分子式与分子量是多少?

分子式 C9H16O2,分子量 156.22。

ALDEHYDE C-18 还有哪些别名?

别名/同义词:ALDEHYDE C-18、Gamma-Nonalactone、Gamma-Nonanolactone。

ALDEHYDE C-18 属于哪个分类?

所属分类:Organic Chemicals。

PubChem 公开数据

ALDEHYDE C-18(CAS 104-61-0)的公开数据库记录,列此仅供独立核对。

危险化学品分类与危害说明

GHS notification summary99.6% (1722 / 1729)

This chemical does not meet GHS hazard criteria for 99.6% (1722 of 1729) of all reports.

Reported as not meeting GHS hazard criteria by 1722 of 1729 companies (only 0.4% companies provided GHS information). For more detailed information, please visit ECHA C&L website.

法规与备案状态

Regulatory & Food ContactEU Flavoring substances
FDA Substance added to food: FLAVORING AGENT OR ADJUVANT
Flavoring Agents
FLAVOURING_AGENT: Flavouring Agent
JECFA ADI: 0-1.25 mg/kg bw (1967)
No safety concern at current levels of intake when used as a flavouring agent. The 1967 ADI of 0-1.25 mg/kg bw
GHS notification summary99.6% (1722 / 1729)

物理形态与操作说明

  • CBI; Liquid; Dry Powder; Liquid
  • Colorless to pale straw-yellow liquid with an odor of coconut; [HSDB]
  • colourless to slightly yellow liquid with a coconut-like odour
  • Colorless to slightly yellow liquid
  • Strong odor reminiscent of coconut
  • Taste characteristics at 10 ppm: coconut, creamy, waxy with fatty milky notes

公开数据库收录的理化数据

沸点BP: 134 °C at 12 mm Hg
沸点121-122 °C (6 mmHg)
密度0.958-0.966 at 25 °C
密度0.958-0.966
折射率1.446-1.450

这个物质在各数据库里的编号

CAS Registry Number104-61-0
PubChem CID7710
分子式C9H16O2
IUPAC 名称5-pentyloxolan-2-one
UNII(FDA)I1XGH66S8P
FEMA 编号2781
JECFA 编号229

数据库记载的用途

  • Reportedly found in peaches, apricots, roasted barley, rum, and tomatoes; Used as flavoring and fragrance ingredient; [HSDB] Used in the US as insecticide, insect and mammal repellent, and mosquito larvicide; [Reference #1]
  • Table: Reported uses (ppm): (Flavor and Extract Manufacturers' Association, 1994) [Table#5371]
  • Flavoring Agents -> JECFA Flavorings Index
  • Flavouring Agent -> FLAVOURING_AGENT -> JECFA Functional Classes
  • Information on 120 consumer products that contain Gamma-nonalactone in the following categories is provided:
  • By reacting methylacrylate and hexanol in the presence of ditertiarybutyl peroxide; by condensation of undecylenic acid and malonic acid by lactonization of nonenoic acid.

它在各数据库里的别名

104-61-0; Gamma-nonalactone; gamma-Nonanolactone; Prunolide; 2(3H)-Furanone, dihydro-5-pentyl-; gamma-Nonanolide; gamma-Pelargolactone; Cocos aldehyde; Nonan-1,4-olide; Coconut aldehyde; gamma-Nonylactone; 1,4-Nonalolide; apricolin; 4-Pentyl-butanolide; Aldehyde C-18; 4-Nonalactone

计算机算出的分子描述符

分子量156.22
XLogP32.2
氢键供体数0
氢键受体数2
可旋转键数4
精确质量156.115029749
单同位素质量156.115029749
拓扑极性表面积26.3
重原子数11
形式电荷0

数据库摘要

ALDEHYDE C-18 · CAS 104-61-0 · C9H16O2. UNII I1XGH66S8P. 沸点: BP: 134 °C at 12 mm Hg; 沸点: 121-122 °C (6 mmHg); 密度: 0.958-0.966 at 25 °C.

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

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