Isononanol (HCID 17072)

概要

7-methyloctan-1-ol is a primary alcohol that is octane which is substituted by a methyl group at position 7 and a hydroxy group at position 1. It is a fragrance ingredient. It has a role as a fragrance.

名称と識別子

優先名称: Isononanol
IUPAC: 7-methyloctan-1-ol
現地名: 7-メチルオクタノール
英語名: 7-METHYL-1-OCTANOL
分子式: C9H20O
分子量: 144.25

名称と別名

Isononyl alcoholIsononanol27458-94-2KY36Z95MC2NEOFLEX 9EXXAL 9SEXXSOL 9EXXAL 9OXOCOL 900RefChem:923744DTXSID6029753248-471-3

名称をさらに表示

7-メチルオクタノール7-メチル-1-オクタノール7-methyl-1-octano7-Methyloctanol (Isononyl Alcohol)7-Methyl-1-octyl Alcohol (unlabelled)7-METHYL-1-OCTANOL ISO 9001：2015 REACH

7-methyloctan-1-ol2430-22-07-Methyloctanol7-METHYL-1-OCTANOL7-Methyl-octanol1-Octanol, 7-methyl-7-Methyl-1-octyl alcoholAlcohols, C8-10-iso-,C9-rich

データベース識別子

CAS: 2430-22-0、27458-94-2、68526-84-1
PubChem CID: 17072
DTXSID: DTXSID2058675
ChEBI: CHEBI:188348
UNII: KY36Z95MC2
EC Number: 248-471-3
Nikkaji: J42.523K

物性

構造計算による物性

XLogP: 3.5
極性表面積: 20.2 Å²
水素結合供与体数: 1
水素結合受容体数: 1
回転可能結合数: 6
重原子数: 10
形式電荷: 0
複雑度: 59.7

実験および物理化学的性質

SpringerMaterials PropertiesDensity

FragrancesFragrance Ingredient (Isononyl alcohol (isomer unspecified)) -> IFRA transparency List

Physical DescriptionLiquid

物理化学的性質

融点: 64.5 °C · 64.5°C
沸点: 192.9 °C · 192.9°C (estimate)
比重(密度): 0.826 · 0.8260
屈折率: 1.4316 · 1.4316
貯蔵温度: Refrigerator
溶解性: クロロホルム、メタノール（微量）
外見: 油
酸解離定数(Pka): 15.2 · 15.20±0.10(Predicted)
色: 無色
Henry's Law Constant: 4.3 · 4.3×10-2 mol/(m3Pa) at 25℃, Yaws (2003)
LogP: 3.23 · 3.230 (est)
EPAの化学物質情報: 1 · 1-Octanol, 7-methyl- (2430-22-0)

化学的性質

化学的特性7-METHYL-1-OCTANOL is Colourless Oil

安全と法規制

GHS分類

GHS Classification · 5 件

This chemical does not meet GHS hazard criteria for 0.2% (1 of 427) of reports.

Danger

H315 (77.3%): Causes skin irritation [Warning Skin corrosion/irritation]

P264, P264+P265, P273, P280, P302+P352, P305+P351+P338, P305+P354+P338, P317, P321, P332+P317, P337+P317, P362+P364, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 427 reports by companies from 9 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

危険有害性情報

Regulatory Information · 5 件

Chemical: 1-Octanol, 7-methyl-

Chemical: Isononanol

Isononanol is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of Isononanol 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)

Status: Active Update: 15-12-2015 https://echa.europa.eu/registration-dossier/-/registered-dossier/13404

Isononanol: Does not have an individual approval but may be used under an appropriate group standard

Other Safety InformationEvaluation - Chemicals that are unlikely to require further regulation to manage risks to environment

Hazard Classes and CategoriesSkin Irrit. 2 (77.3%)

化学と産業

用途と製造

U.S. Production2023: 5,000,000 - <10,000,000 lb

Industry UsesIntermediate

Use ClassificationFragrance Ingredients

General Manufacturing InformationAll Other Basic Inorganic Chemical Manufacturing

応用分野

使用7-METHYL-1-OCTANOL is used in the synthesis of the sex pheromone of Elater ferrugineus.

上流・下流製品情報

下流製品

フタル酸ジイソノニル 1,2-Bis(7-Methyloctyl)cyclohexyl-1,2-dicarboxylate

サプライヤー50 社

湖北永阔科技有限公司027-59223108 15972152991 · [email protected]

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

湖北万得化工有限公司15377098680 15377098680 · [email protected]

艾特（浙江）供应链管理有限公司15553101207 18615619105

山东隆汇化工有限公司531-88613858 15562516958 · [email protected]

Isononanol

基本情報

概要