4-ノニルフェノールモノエトキシレート標準液

2-(p-Nonylphenoxy)ethanol

HCID 7700CAS 104-35-8

基本情報

標準SMILES: CCCCCCCCCc1ccc(OCCO)cc1
InChIKey: KUXGUCNZFCVULO-UHFFFAOYSA-N
分子式: C17H28O2
平均分子量: 264.4 g/mol
単同位体質量: 264.20893014

概要

Tergitol is a poly(ethylene glycol) derivative that is poly(ethylene glycol) in which one of the terminal hydroxy groups has been converted into the corresponding p-nonylphenyl ether. It has a role as a nonionic surfactant. It is a poly(ethylene glycol) derivative and a hydroxypolyether.

名称と識別子

優先名称: 2-(p-Nonylphenoxy)ethanol
IUPAC: 2-(4-nonylphenoxy)ethanol
現地名: 4-ノニルフェノールモノエトキシレート標準液
英語名: 4-Nonylphenol-mono-ethoxylate
分子式: C17H28O2
分子量: 264.4

名称と別名

2-(p-Nonylphenoxy)ethanolEthanol, 2-(4-nonylphenoxy)-ZMD36H3ESXRefChem:10619582-(4-nonylphenoxy)ethanolNonoxinol104-35-84-Nonyl Phenol Monoethoxylate4-Nonylphenol Monoethoxylate2-(4-nonylphenoxy)ethan-1-ol4-Nonylphenol-mono-ethoxylate4-nonylphenol ethoxylate

名称をさらに表示

4-ノニルフェノールモノエトキシレート標準液4‐ノニルフェノールモノエトキシレート標準液4-n-Nonylphenol MonoethoxylateISOMERMIXP-N-NONYLPHENOL MONOETHOXYLATEETHYLENE GLYCOL MONO(P-NONYLPHENYL) ETHER4-n-Nonylphenol-mono-ethoxylate 10 μg/mL in Acetone4-n-Nonylphenol-mono-ethoxylate 10 μg/mL in Methanol4-n-Nonylphenol monoethoxylate@100 μg/mL in MethanolP-NONYLPHENOL MONOETHOXYLATE, UNLABELED (100UG/ML IN NONANE)

96827-63-34-Nonyl Phenol Monoethoxylate-d4DTXSID20365884-Nonylphenol branched ethoxylatedNonoxinol 9 CRSDelfen (TN)Nonoxynol 9 (USP)Nonoxynol 4 (USAN)

データベース識別子

CAS: 104-35-8
PubChem CID: 7700
DTXSID: DTXSID4058601
ChEMBL: CHEMBL1797943
ChEBI: CHEBI:53774
UNII: ZMD36H3ESX
Nikkaji: J592.103A

物性

構造計算による物性

XLogP: 5.5
極性表面積: 29.5 Å²
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: 11
重原子数: 19
形式電荷: 0
複雑度: 186

実験および物理化学的性質

SurfactantsSurfactant -> linear alkylbenzyl sulfonate (LAS)

Endocrine DisruptorsPotential endocrine disrupting compound

物理化学的性質

沸点: 367.63 °C · 367.63°C (rough estimate)
比重(密度): 0.9716 · 0.9716 (rough estimate)
屈折率: 1.5 · 1.5000 (estimate)
貯蔵温度: Refrigerator
溶解性: Chloroform (Slightly), DMSO (Slightly), Ethyl Acetate (Slightly)
外見: Low-Melting Solid
酸解離定数(Pka): 14.29 · 14.29±0.10(Predicted)
色: White to Brown
水溶解度: 3.384 mg/L · 3.384mg/L(25℃)
EPAの化学物質情報: 2 · Ethanol, 2-(4-nonylphenoxy)- (104-35-8)

化学的性質

化学的特性is Brown Low Melting Solid

安全と法規制

GHS分類

GHS Classification · 4 件

Warning

H312 (100%): Harmful in contact with skin [Warning Acute toxicity, dermal]

P260, P264, P264+P265, P273, P280, P302+P352, P305+P351+P338, P317, P319, P321, P332+P317, P337+P317, P362+P364, P391, and P501 (click each P-code to see the statement)

The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

危険有害性情報

Regulatory InformationHazard Traits - Endocrine toxicity

Hazard Classes and CategoriesAcute Tox. 4 (100%)

安全データ

化審法: 優先評価化学物質
安衛法: 有機溶剤中毒予防規則:第2種有機溶剤,57,57-2
消防法: 危-4-1-S-II

化学と産業

応用分野 · 1 件

使用is used as analytical standard for environmental analysis. ISO/CD 18857-2 (International Organization for Standardization, Geneva) describes a new international standard method for the determination of o ctylphenol, nonylphenol, their mono- and diethyoxylates, and bisphenol A in nonfiltered samples of drinking, groundwater, surface water, and wastewater.