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1,2-エポキシオクタデカン

1,2-Epoxyoctadecane

HCID 23872
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印刷プレビュー
基本情報概要名称と識別子物性安全と法規制化学と産業関連反応化合物ノート
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基本情報

CAS
7390-81-0
標準SMILES
CCCCCCCCCCCCCCCCC1CO1
InChIKey
QBJWYMFTMJFGOL-UHFFFAOYSA-N
分子式
C18H36O
平均分子量
268.5 g/mol
単同位体質量
268.27661577

概要

1,2-epoxyoctadecane appears as white waxy or chunky solid. (NTP, 1992)

名称と識別子

優先名称
1,2-Epoxyoctadecane
IUPAC
2-hexadecyloxirane
現地名
1,2-エポキシオクタデカン
英語名
1,2-Epoxyoctadecane
分子式
C18H36O
分子量
268.48

名称と別名

1,2-EPOXYOCTADECANE7390-81-02-HexadecyloxiraneHexadecyloxiraneOxirane, hexadecyl-1,2-Octadecylene OxideOxirane, 2-hexadecyl-octadecylene oxideO8GK4E0CVL1,2-OCTADECENE EPOXIDEOCTADECANE, 1,2-EPOXY-J91.342A
名称をさらに表示
1,2-エポキシオクタデカン2-ヘキサデシルオキシランヘキサデシルオキシラン1,2-オクタデシレンオキシド2-ヘキサデカン-1-イルオキシラン1-(オキシラン-2-イル)ヘキサデカンhexadecyl-oxiranhexadecyl-OxiraneOxirane,hexadecyl-1-Octadecene oxide1,2-Octadecane oxide
DTXSID4025246RefChem:72061OCTADECENE EPOXIDEVIKOLOX 18DTXCID505246230-977-0MFCD00005152CCRIS 2619

データベース識別子

CAS
7390-81-0
PubChem CID
23872
DTXSID
DTXSID4025246
UNII
O8GK4E0CVL
EC Number
230-977-0
Nikkaji
J91.342A

物性

構造計算による物性

XLogP
8.4
極性表面積
12.5 Ų
水素結合供与体数
0
水素結合受容体数
1
回転可能結合数
15
重原子数
19
形式電荷
0
複雑度
179

実験および物理化学的性質

PolymersPlastics & Rubber -> Epoxides
Density0.83 at 68 °F (NTP, 1992) - Less dense than water; will float
Solubilityless than 1 mg/mL at 70 °F (NTP, 1992)
Endocrine DisruptorsPotential endocrine disrupting compound
Boiling Point279 °F at 0.5 mmHg (NTP, 1992)
Melting Point79 °F (NTP, 1992)
Physical Description · 2 件

1,2-epoxyoctadecane appears as white waxy or chunky solid. (NTP, 1992)

White solid; mp = 26 deg C; [CAMEO] White solid; mp = 30-35 deg C; [Alfa Aesar MSDS]

物理化学的性質

融点
33 · 33-35°C
沸点
146 · 146-148°C 1mm
比重(密度)
0.9227 · 0.9227 (rough estimate)
屈折率
1.45 · 1.4500 (estimate)
闪点
176 °C · 176°C

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 · 6 件

This chemical does not meet GHS hazard criteria for 8.3% (4 of 48) of reports.

Warning

H315 (91.7%): Causes skin irritation [Warning Skin corrosion/irritation]

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 48 reports by companies from 5 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Warning

危険有害性情報

Regulatory InformationChemical: Oxirane, hexadecyl-
Other Safety InformationIMAP assessments - Long-chain alkyl oxiranes: Human health tier II assessment
Fire HazardsFlash point data for this chemical are not available, but it is probably combustible. (NTP, 1992)
Health HazardsACUTE/CHRONIC HAZARDS: This compound is a local irritant. (NTP, 1992)
Hazards SummaryMay violently polymerize; [CAMEO] A local irritant; [NTP] A skin and strong eye irritant; [Alfa Aesar MSDS]
Reactive GroupEpoxides
Reactivity AlertsPolymerizable
Reactivity Profile · 1 件

1,2-EPOXYOCTADECANE, an epoxide, is sensitive to exposure to moisture. This compound is incompatible with strong acids, caustics and peroxides. (NTP, 1992). Epoxides are highly reactive. They polymerize in the presence of catalysts or when heated. These polymerization reactions can be violent. Compounds in this group react with acids, bases, and oxidizing and reducing agents. They react, possibly violently with water in the presence of acid and other catalysts.

化学と産業

用途と製造

General Manufacturing InformationOxirane, 2-hexadecyl-: ACTIVE

応用分野

使用1,2-Epoxyoctadecane can be used to produce octadecane-1,2-diol at heating. It is used in agrochemical, pharmaceutical and dyestuff field .

一般的な説明White waxy or chunky solid.

上流・下流製品情報

上流原料

1-オクタデセンエタンペルオキシ酸酢酸

関連反応

9 件
反応記録を作成
HRID 1108 の反応式
HRID 1108反応物としてuspto-grants-1998_03
HRID 1109 の反応式
HRID 1109反応物としてuspto-grants-1998_03
HRID 1122 の反応式
HRID 1122反応物としてuspto-grants-1998_03
HRID 291897 の反応式
HRID 291897反応物としてTraining data from https://doi.org/10.1039/C8SC04228D (8/10)
HRID 721997 の反応式
HRID 721997反応物としてuspto-grants-2006_11
HRID 839771 の反応式
HRID 839771反応物としてuspto-grants-1978_06
HRID 1210178 の反応式
HRID 1210178反応物としてTraining data from https://doi.org/10.1039/C8SC04228D (5/10)
HRID 1560003 の反応式
HRID 1560003反応物としてTraining data from https://doi.org/10.1039/C8SC04228D (1/10)
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化合物ノート

読み込み中…

このページの内容基本情報概要名称と識別子物性安全と法規制化学と産業関連反応化合物ノート
その他の操作
ノートを作成反応を作成見積依頼を出す
貯蔵温度
Store at room temperature
外見
powder to lump to clear liquid
色
White or Colorless to Almost white or Almost colorless
水溶解度
水に不溶。
BRN
115434 · 115434
安定性
安定。可燃性。強酸、過酸化物、腐食剤とは相容れない。湿気に敏感。
CAS データベース
7390 · 7390-81-0(CAS DataBase Reference)
NISTの化学物質情報
Oxirane, hexadecyl-(7390-81-0)
EPAの化学物質情報
1 · 1,2-Epoxyoctadecane (7390-81-0)

化学的性質

化学的特性white waxy solid

Air and Water ReactionsThis chemical is sensitive to exposure to moisture. Insoluble in water.
Hazard Classes and Categories · 2 件

Skin Irrit. 2 (91.7%)

Skin irritation - category 2

安全と保護具

Fire FightingFires involving this material can be controlled with a dry chemical, carbon dioxide or Halon extinguisher. (NTP, 1992)
First Aid · 1 件

EYES: First check the victim for contact lenses and remove if present. Flush victim's eyes with water or normal saline solution for 20 to 30 minutes while simultaneously calling a hospital or poison control center. Do not put any ointments, oils, or medication in the victim's eyes without specific instructions from a physician. IMMEDIATELY transport the victim after flushing eyes to a hospital even if no symptoms (such as redness or irritation) develop.

Nonfire Spill Response · 1 件

SMALL SPILLS AND LEAKAGE: If a spill of this chemical occurs, FIRST REMOVE ALL SOURCES OF IGNITION, then you should dampen the solid spill material with acetone and transfer the dampened material to a suitable container. Use absorbent paper dampened with acetone to pick up any remaining material. Seal your contaminated clothing and the absorbent paper in a vapor-tight plastic bag for eventual disposal. Solvent wash all contaminated surfaces with acetone followed by washing with a soap and water solution. Do not reenter the contaminated area until the Safety Officer (or other responsible person) has verified that the area has been properly cleaned.

Personal Protective Equipment (PPE) · 1 件

RECOMMENDED RESPIRATOR: Where the neat test chemical is weighed and diluted, wear a NIOSH-approved half face respirator equipped with an organic vapor/acid gas cartridge (specific for organic vapors, HCl, acid gas and SO2) with a dust/mist filter. (NTP, 1992)

安全データ

tsca
TSCA listed
hs_code
2910.90.9100
risk_code
36/38-36/37/38
化審法
(2)-220
hazard_code
Xi
safety_code
26-36-37/39