Dihydro-Alpha-ionone

CAS 31499-72-6C13H22OMW 194.17 g/mol

Dihydro-Alpha-ionone（CAS 31499-72-6）：分子式 C13H22O、分子量 194.17 g/mol。

产品概览

CAS号	31499-72-6
分子式	C13H22O
分子量	194.17 g/mol
沸点	234 °C
LogP	2.8
应用领域	Use Classification: Fragrance Ingredients、Flavouring Agent -> FLAVOURING_AGENT -> JECFA Functional Classes、Flavoring Agents -> JECFA Flavorings Index、General Manufacturing Information: 2-Butanone、4-(2、6、6-trimethyl-2-cyclohexen-1-yl)-: ACTIVE

应用领域

登记用途：Use Classification: Fragrance Ingredients、Flavouring Agent -> FLAVOURING_AGENT -> JECFA Functional Classes、Flavoring Agents -> JECFA Flavorings Index、General Manufacturing Information: 2-Butanone、4-(2、6、6-trimethyl-2-cyclohexen-1-yl)-: ACTIVE。

技术档案

这个产品是什么

Dihydro-Alpha-ionone 是一种化工化合物，登记 CAS 号为 31499-72-6，分子式 C13H22O（分子量 194.17 g/mol）。

识别信息

登记 CAS 号：31499-72-6

其分子式 C13H22O 由 13 个碳、22 个氢、1 个氧组成。

别名/同义词：Dihydro-Alpha-ionone · 4-(2,6,6-trimethyl-2-cyclohexen-1-yl)butan-2-one

常见问题

Dihydro-Alpha-ionone 的 CAS 号是多少？

Dihydro-Alpha-ionone 的 CAS 登记号为 31499-72-6。

Dihydro-Alpha-ionone 的分子式与分子量是多少？

分子式 C13H22O，分子量 194.17 g/mol。

Dihydro-Alpha-ionone 还有哪些别名？

别名/同义词：Dihydro-Alpha-ionone、4-(2,6,6-trimethyl-2-cyclohexen-1-yl)butan-2-one。

Dihydro-Alpha-ionone 的登记用途是什么？

PubChem 公开数据

Dihydro-Alpha-ionone（CAS 31499-72-6）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 Number	31499-72-6
PubChem CID	35821
Molecular formula	C13H22O
Molecular weight	194.17 g/mol
IUPAC name	4-(2,6,6-trimethylcyclohex-2-en-1-yl)butan-2-one
InChIKey	JHJCHCSUEGPIGE-UHFFFAOYSA-N
UNII (FDA)	20P9Z50AR5
ChEBI ID	CHEBI:191058
FEMA number	3628
JECFA number	393

计算分子描述符

Molecular Weight	194.31
XLogP3	2.8
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	3
Exact Mass	194.167065321
Monoisotopic Mass	194.167065321
Topological Polar Surface Area	17.1
Heavy Atom Count	14

在册的理化数值

Boiling Point	234 °C
Density	0.919-0.927
Refractive Index	1.476-1.482

在册的记载用途

同义词与商品名

Dihydro-alpha-ionone; 4-(2,6,6-trimethylcyclohex-2-en-1-yl)butan-2-one; FEMA No. 3628; EINECS 250-657-4; 4-(2,6,6-Trimethyl-2-cyclohexen-1-yl)-2-butanone; Dihydro-.alpha.-ionone; 2-BUTANONE, 4-(2,6,6-TRIMETHYL-2-CYCLOHEXEN-1-YL)-; alpha-Dihydroionone; .alpha.-7,8-Dihydroionone; UNII-20P9Z50AR5; .alpha.-Dihydroionone; 4-(2,2,6-Trimethyl-5-cyclohexen-1-yl)-2-butanone; 4-(2,6,6-Trimethyl-2-cyclohexen-1-yl)butan-2-one; AI3-32481; 20P9Z50AR5; 4-(2,6,6-Trimethyl-2-cyclohexen-1-yl-2-butanone

已收录的法规名录

Regulatory & Food Contact	EU Flavoring substances FDA Substance added to food: FLAVORING AGENT OR ADJUVANT Flavoring Agents FLAVOURING_AGENT: Flavouring Agent Fruit No safety concern at current levels of intake when used as a flavouring agent
GHS notification summary	85.9% (237 / 276)

GHS 危害分类

GHS notification summary	85.9% (237 / 276)
Reported hazard statements	H315 (14.1%), H319 (14.1%), H335 (14.1%)

This chemical does not meet GHS hazard criteria for 85.9% (237 of 276) of all reports.

H315 (14.1%): Causes skin irritation [Warning Skin corrosion/irritation]

公开数据库对它的描述

Dihydro-Alpha-ionone is identified by CAS 31499-72-6, molecular formula C13H22O and molecular weight 194.17 g/mol. UNII 20P9Z50AR5; ChEBI 191058; InChIKey JHJCHCSUEGPIGE-UHFFFAOYSA-N. Boiling Point: 234 °C; Density: 0.919-0.927; Refractive Index: 1.476-1.482.

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。

Dihydro-Alpha-ionone

产品概览

应用领域

技术档案

这个产品是什么

识别信息

常见问题

PubChem 公开数据

各数据库的登记标识

计算分子描述符

在册的理化数值

在册的记载用途

同义词与商品名

已收录的法规名录

GHS 危害分类

公开数据库对它的描述

物理形态与操作说明

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