1-(2-ヒドロキシエチル)-2-ウンデシル-2-イミダゾリン
1-(2-Hydroxyethyl)-2-undecylimidazoline
基本情報
- CAS
136-99-2- 標準SMILES
CCCCCCCCCCCC1=NCCN1CCO- InChIKey
QNDGQRJVVZJMJO-UHFFFAOYSA-N- 分子式
- C16H32N2O
- 平均分子量
- 268.44 g/mol
- 単同位体質量
- 268.25146365
名称と識別子
- 優先名称
- 1-(2-Hydroxyethyl)-2-undecylimidazoline
- IUPAC
- 2-(2-undecyl-4,5-dihydroimidazol-1-yl)ethanol
- 現地名
- 1-(2-ヒドロキシエチル)-2-ウンデシル-2-イミダゾリン
- 英語名
- 4,5-dihydro-2-undecyl-1H-imidazole-1-ethanol
- 分子式
- C16H32N2O
- 分子量
- 268.44
名称と別名
4,5-Dihydro-2-undecyl-1H-imidazole-1-ethanolLauryl hydroxyethyl imidazoline1H-Imidazole-1-ethanol, 4,5-dihydro-2-undecyl-Nalcamine G-11HSDB 5622UNII-0B4PCW98KD1-(2-HYDROXYETHYL)-2-UNDECYLIMIDAZOLINE1-(2-hydroxyethyl)-2-undecyl-2-imidazolineMACKAZOLINE 95L1-Hydroxyethyl-2-undecylimidazolineEINECS 205-271-0NALCAMINE G 11
名称をさらに表示
2-ウンデシル-4,5-ジヒドロ-1H-イミダゾール-1-エタノール1-(2-ヒドロキシエチル)-2-ウンデシル-2-イミダゾリン2-ウンデシル-2-イミダゾリン-1-エタノール4,5-ジヒドロ-2-ウンデシル-1H-イミダゾール-1-エタノールLURYLIMIDAZOLINE2-Undecyl-2-imidazoline-1-ethanol1-(2-Hydroxyethyl)-2-undecylimadazoline4,5-dihydro-2-undecyl-1h-imidazole-1-ethano2-Undecyl-4,5-dihydro-1H-imidazole-1-ethanol
DTXSID0059667HYDROXYETHYLLAURYLGLYOXALIDINE2-UNDECYL-1-(2-HYDROXYETHYL)-2-IMIDAZOLINE1-(2-HYDROXYETHYL)-2-UNDECYLIMIDAZOLINE [HSDB]Nalcamine G11RefChem:741762Undecyl2imidazoline1ethanol2Imidazoline1ethanol, 2undecyl
データベース識別子
- CAS
136-99-2- PubChem CID
- 8709
- DTXSID
DTXSID0059667- ChEMBL
CHEMBL4454230- UNII
- 0B4PCW98KD
- EC Number
- 205-271-0
- Nikkaji
- J184.406G
物性
構造計算による物性
- XLogP
- 3.9
- 極性表面積
- 35.8 Ų
- 水素結合供与体数
- 1
- 水素結合受容体数
- 2
- 回転可能結合数
- 12
- 重原子数
- 19
- 形式電荷
- 0
- 複雑度
- 241
実験および物理化学的性質
Chemical ClassesNitrogen Compounds -> Imidazoles
CosmeticsSurfactant; Hair conditioning; Antistatic
Physical DescriptionLiquid
物理化学的性質
- 融点
- 57 °C · 57 °C
- 沸点
- 210 · 210-220 °C(Press: 1 Torr)
- 比重(密度)
- 0.98 · 0.98±0.1 g/cm3(Predicted)
- 蒸気圧
- 0 Pa · 0Pa at 20℃
- 酸解離定数(Pka)
- 15.07 · 15.07±0.10(Predicted)
- 水溶解度
- 33.9 mg/L · 33.9mg/L at 20℃
- 化粧品成分の機能
- ヘアコンディショニング帯電防止
- LogP
- 1.85 at · 1.85 at 20℃
- EPAの化学物質情報
- 1 H-Imidazole-1-ethanol, · 1H-Imidazole-1-ethanol, 4,5-dihydro-2-undecyl- (136-99-2)
安全と法規制
安全情報は参考情報です。供給元の安全データシート（SDS）、適用法令、専門家による評価に代わるものではありません。
GHS分類
GHS Classification
This chemical does not meet GHS hazard criteria for 96.7% (441 of 456) of all reports.
Not Classified
Aggregated GHS information provided per 456 reports by companies from 4 notifications to the ECHA C&L Inventory.
Warning
H302: Harmful if swallowed [Warning Acute toxicity, oral]
P264, P270, P273, P301+P317, P330, P391, and P501 (click each P-code to see the statement)
危険有害性情報
Regulatory Information
Chemical: 1H-Imidazole-1-ethanol, 4,5-dihydro-2-undecyl-
1H-Imidazole-1-ethanol, 4,5-dihydro-2-undecyl- is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of 1H-Imidazole-1-ethanol, 4,5-dihydro-2-undecyl- 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: 4,5-dihydro-2-undecyl-1H-imidazole-1-ethanol (EC: 205-271-0)
1H-Imidazole-1-ethanol, 4,5-dihydro-2-undecyl-: Does not have an individual approval but may be used under an appropriate group standard
Other Safety InformationEvaluation - Long-chain alkyl hydroxyethyl imidazolines
Hazards SummarySee Imidazole.
Hazard Classes and Categories
Not Classified
Acute toxicity (ingestion) - category 4
Acute toxicity (Oral) - Category 4
安全データ
- tsca
- TSCA listed
- ridadr
- 3267
- hazard_class
- 8
- packing_group
化学と産業
用途と製造
Uses
Used as a corrosion inhibitor in paints and cutting oils and as a chemical intermediate for other surfactants; Used in mixtures as a textile softener and antistatic agent, corrosion inhibitor and fungicide in the petroleum industry, antistatic agent for plastic films, acid cleaner, emulsifier (tar, asphalt, and pesticides), wetting agent, and cosmetic ingredient; [HSDB]
Acid and Alkali Cleaning of Metals [Category: Clean]
TEXTILE ASSISTANT, SOFTENER & ANTISTATIC AGENT (AS MIXT)
CORROSION INHIBITOR & FUNGICIDE IN PETROLEUM INDUST-MIXT
CORROSION INHIBITOR, EG, IN LATEX PAINTS, CUTTING OILS
ACID CLEANER-EG, FOR DAIRY CANS, TOILETS, METALS-AS MIXT
U.S. Exports
(1979) No Data
(1981) No Data
U.S. Imports
(1979) No Data
(1981) No Data
U.S. Production
2023: 550,000 - <700,000 lb
(1977) AT LEAST 5.0X10+8 GRAMS
(1981) 6.63X10+7 G (MIXT WITH C13 ANALOGUE)
Industry UsesIntermediate
Methods of ManufacturingREACTION OF LAURIC ACID WITH (2-HYDROXYETHYL)ETHYLENEDIAMINE, FOLLOWED BY HEATING TO ELIMINATE WATER (COMMERCIAL PRODUCT IS A MIXTURE OBTAINED BY USING COCONUT OIL FATTY ACIDS AS THE RAW MATERIAL)
Use ClassificationCosmetics -> Surfactant; Hair conditioning; Antistatic
General Manufacturing Information
All Other Basic Organic Chemical Manufacturing
1H-Imidazole-1-ethanol, 4,5-dihydro-2-undecyl-: ACTIVE
"NALCAMINE" TRADEMARK FOR A GROUP OF ORGANIC AMINES. /NALCAMINE/
関連反応
6 件
化合物ノート
読み込み中…