Gamma-Terpinene (HCID 7461)

概要

Gamma-terpinene is one of three isomeric monoterpenes differing in the positions of their two double bonds (alpha- and beta-terpinene being the others). In gamma-terpinene the double bonds are at the 1- and 4-positions of the p-menthane skeleton. It has a role as an antioxidant, a volatile oil component, a plant metabolite and a human xenobiotic metabolite. It is a monoterpene and a cyclohexadiene.

名称と識別子

優先名称: Gamma-Terpinene
IUPAC: 1-methyl-4-propan-2-ylcyclohexa-1,4-diene
英語名: 4-Isopropyl-1-methyl-1,4-cyclohexadiene
分子式: C10H16
分子量: 136.23

名称と別名

GAMMA-TERPINENE99-85-4p-Mentha-1,4-dieneCrithmeneMoslenegamma-Terpinen4-Isopropyl-1-methyl-1,4-cyclohexadiene1,4-p-Menthadiene1-Isopropyl-4-methyl-1,4-cyclohexadiene1,4-Cyclohexadiene, 1-methyl-4-(1-methylethyl)-1-methyl-4-propan-2-ylcyclohexa-1,4-diene1-Methyl-4-(1-methylethyl)-1,4-cyclohexadiene

名称をさらに表示

1-methyl-4-(propan-2-yl)cyclohexa-1,4-diene1-isopropyl-4-methylcyclohexa-1,4-dieneFEMA No. 3559DTXSID60412104YGF4PQP49NSC-21448DTXCID4021210CHEBI:10577

データベース識別子

CAS: 99-85-4
PubChem CID: 7461
DTXSID: DTXSID6041210
ChEMBL: CHEMBL449693
ChEBI: CHEBI:10577
UNII: 4YGF4PQP49
EC Number: 202-794-6
Nikkaji: J4.974C

物性

構造計算による物性

XLogP: 2.8
極性表面積: 0 Å²
水素結合供与体数: 0
水素結合受容体数: 0
回転可能結合数: 1
重原子数: 10
形式電荷: 0
複雑度: 170

実験および物理化学的性質

Chemical ClassesBiological Agents -> Terpenes

LipidsLipids -> Prenol Lipids [PR] -> Isoprenoids [PR01] -> C10 isoprenoids (monoterpenes) [PR0102]

SpringerMaterials PropertiesDensity

FragrancesFragrance Ingredient (p-Mentha-1,4-diene) -> IFRA transparency List

LogP · 2 件

4.50

4.5

Food AdditivesFLAVORING AGENT OR ADJUVANT -> FDA Substance added to food

物理化学的性質

融点: -10 °C · -10 °C
沸点: 183 °C · 183 °C
比重(密度): 0.849 g/cm3 · 0.849 g/cm3

安全と法規制

GHS分類

GHS Classification · 6 件

This chemical does not meet GHS hazard criteria for 0.1% (3 of 2186) of reports.

Danger

H226 (99.4%): Flammable liquid and vapor [Warning Flammable liquids]

P210, P233, P240, P241, P242, P243, P273, P280, P301+P316, P303+P361+P353, P331, P370+P378, P391, P403+P235, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 2186 reports by companies from 29 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Danger

危険有害性情報

Regulatory Information · 5 件

Chemical: 1,4-Cyclohexadiene, 1-methyl-4-(1-methylethyl)-

Commission Regulation (EC) No 1565/2000 (Repealed by Com. Implementing Reg. (EU) No 872/2012)

1,4-Cyclohexadiene, 1-methyl-4-(1-methylethyl)- is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of 1,4-Cyclohexadiene, 1-methyl-4-(1-methylethyl)- are required to report information about their production and use of this chemical to the EPA under the Toxic Substances Control Act (TSCA). (40 eCFR Part 711)

REACH registered substance: p-mentha-1,4-diene (EC: 202-794-6)

gamma-Terpinene: Does not have an individual approval but may be used under an appropriate group standard

Other Safety InformationIMAP assessments - Terpinene, terpinolene and phellandrene: Human health tier II assessment

Hazards SummaryA moderate skin irritant; [RTECS] Safe when used as a flavoring agent in food; [JECFA] A skin and strong eye irritant; [Sigma-Aldrich MSDS] See Terpinolene. See TERPENES.

Hazard Classes and Categories · 2 件

Flam. Liq. 3 (99.4%)

Aspiration hazard - category 1

毒性情報

Adverse EffectsNeurotoxin - Acute solvent syndrome

Carcinogen ClassificationNo indication of carcinogenicity to humans (not listed by IARC).

安全データ

注意喚起語: 警告
危険有害性情報: コード危険有害性情報危険有害性クラス区分注意喚起語シンボル P コード H226

化学と産業

薬理情報

Cellular LocationsExtracellular

用途と製造

UsesUsed as a flavoring agent; [FDA] Permitted for use as an inert ingredient in non-food pesticide products; [EPA]

U.S. Production2023: 1,000,000 - <2,500,000 lb

Consumer UsesOdor agents

Industry UsesFragrance

Household ProductsInformation on 33 consumer products that contain Gamma-Terpinene in the following categories is provided:

Use Classification · 4 件

Fragrance Ingredients

Flavouring Agent -> FLAVOURING_AGENT -> JECFA Functional Classes

Flavoring Agents -> JECFA Flavorings Index

Flavouring Agent -> FLAVOURING_AGENT -> JECFA Functional Classes

サプライヤー50 社

梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]

上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]

Shandong chuangyingchemical Co., Ltd.18853181302 · [email protected]

河北创海生物科技有限公司+86-86-13131129325 · [email protected]

云南西力生物技术股份有限公司0871-65217109 · [email protected]

Gamma-Terpinene

基本情報

概要