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1,3,3-Trimethyl-2-norbornanyl acetate

CAS 13851-11-1C12H20O2MW 196.15 g/mol

1,3,3-Trimethyl-2-norbornanyl acetate(CAS 13851-11-1):分子式 C12H20O2、分子量 196.15 g/mol。

规格参数

CAS号13851-11-1
分子式C12H20O2
分子量196.15 g/mol
沸点220 °C
LogP3.1

采购档案

这个产品是什么

1,3,3-Trimethyl-2-norbornanyl acetate 是一种化工化合物,登记 CAS 号为 13851-11-1,分子式 C12H20O2(分子量 196.15 g/mol)。

识别信息

登记 CAS 号:13851-11-1

其分子式 C12H20O2 由 12 个碳、20 个氢、2 个氧 组成。

别名/同义词:1,3,3-Trimethyl-2-norbornanyl acetate · Fenchyl Acetate

常见问题

1,3,3-Trimethyl-2-norbornanyl acetate 的 CAS 号是多少?

1,3,3-Trimethyl-2-norbornanyl acetate 的 CAS 登记号为 13851-11-1。

1,3,3-Trimethyl-2-norbornanyl acetate 的分子式与分子量是多少?

分子式 C12H20O2,分子量 196.15 g/mol。

1,3,3-Trimethyl-2-norbornanyl acetate 还有哪些别名?

别名/同义词:1,3,3-Trimethyl-2-norbornanyl acetate、Fenchyl Acetate。

PubChem 公开数据

1,3,3-Trimethyl-2-norbornanyl acetate(CAS 13851-11-1)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 summary16.8% (276 / 1644)
Reported hazard statementsH317 (78.3%), H341 (78.3%), H351 (78.3%)

This chemical does not meet GHS hazard criteria for 16.8% (276 of 1644) of reports.

H317 (78.3%): May cause an allergic skin reaction [Warning Sensitization, Skin]

法规与备案状态

Regulatory & Food ContactEU Flavoring substances
FDA Substance added to food: FLAVOR ENHANCER, FLAVORING AGENT OR ADJUVANT
Flavoring Agents
FLAVOURING_AGENT: Flavouring Agent
Floral
No safety concern at current levels of intake when used as a flavouring agent
GHS notification summary16.8% (276 / 1644)

物理形态与操作说明

  • Liquid
  • Colourless mobile liquid; Mild, sweet, fir oil type aroma
  • Soluble in oils; Slightly soluble in water
  • Soluble (in ethanol)

公开数据库收录的理化数据

沸点220 °C
密度0.973-0.979
折射率1.456-1.462

这个物质在各数据库里的编号

CAS Registry Number13851-11-1
PubChem CID107217
分子式C12H20O2
分子量196.15 g/mol
IUPAC 名称(1,3,3-trimethyl-2-bicyclo[2.2.1]heptanyl) acetate
InChIKeyJUWUWIGZUVEFQB-UHFFFAOYSA-N
UNII(FDA)I8JL13M20M
ChEBI 编号CHEBI:172037
FEMA 编号3390
JECFA 编号1399

数据库记载的用途

  • Flavouring Agent -> FLAVOURING_AGENT -> JECFA Functional Classes
  • Flavoring Agents -> JECFA Flavorings Index
  • Information on 5 consumer products that contain Fenchyl Acetate in the following categories is provided:
  • Bicyclo[2.2.1]heptan-2-ol, 1,3,3-trimethyl-, 2-acetate: ACTIVE

它在各数据库里的别名

1,3,3-Trimethyl-2-norbornanyl acetate; RefChem:906799; Fenchyl acetate; 13851-11-1; Fenchylacetate; 2-Norbornanol, 1,3,3-trimethyl-, acetate; FEMA No. 3390; 3,3-Dimethyl-8,9-dinorbornan-2-yl acetate; 1,3,3-trimethylbicyclo[2.2.1]heptan-2-yl acetate; (1,3,3-trimethyl-2-bicyclo[2.2.1]heptanyl) acetate; I8JL13M20M; DTXSID2047197; NSC-404295; Bicyclo(2.2.1)heptan-2-ol, 1,3,3-trimethyl-, acetate; Bicyclo[2.2.1]heptan-2-ol, 1,3,3-trimethyl-, acetate; Bicyclo(2.2.1)heptan-2-ol, 1,3,3-trimethyl-, 2-acetate

计算机算出的分子描述符

分子量196.29
XLogP33.1
氢键供体数0
氢键受体数2
可旋转键数2
精确质量196.146329876
单同位素质量196.146329876
拓扑极性表面积26.3
重原子数14
形式电荷0

数据库摘要

1,3,3-Trimethyl-2-norbornanyl acetate is identified by CAS 13851-11-1, molecular formula C12H20O2 and molecular weight 196.15 g/mol. UNII I8JL13M20M; ChEBI 172037; InChIKey JUWUWIGZUVEFQB-UHFFFAOYSA-N. 沸点: 220 °C; 密度: 0.973-0.979; Refractive Index: 1.456-1.462.

内容整理自公开化学数据库。若数据库数值与随货 COA 不一致,以批次 COA 为准。

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