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アリル エチル エーテル

Allyl ethyl ether

HCID 11191
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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
557-31-3
標準SMILES
C=CCOCC
InChIKey
OJPSFJLSZZTSDF-UHFFFAOYSA-N
分子式
C5H10O
平均分子量
86.13 g/mol
単同位体質量
86.07316494

概要

Allyl ethyl ether appears as a liquid. Insoluble in water and less dense than water. Hence floats on water. Emits acrid irritating fumes when heated to high temperature. Used to make other chemicals.

名称と識別子

優先名称
Allyl ethyl ether
IUPAC
3-ethoxyprop-1-ene
現地名
アリル エチル エーテル
英語名
Allyl ethyl ether
分子式
C5H10O
分子量
86.13

名称と別名

ALLYL ETHYL ETHER1-Propene, 3-ethoxy-3-Ethoxy-1-propeneEthyl allyl etherEther, allyl ethyl3-EthoxypropeneEthyl 2-propenyl etherUNII-SM8T658RE3UN2335SM8T658RE3EINECS 209-169-7CH3CH2OCH2CH=CH2
名称をさらに表示
アリル エチル エーテルアリルエチルエーテル3-エトキシ-1-プロペンエチルアリルエーテルETHOXY-1-PROPENE3-ethoxy-1-propen3-ethoxyprop-1-eneEthyl2-propenylether
AI3-24223ALLYL ETHYL ETHER [MI]DTXSID4060319UN 2335UN-23353Ethoxy1propene1Propene, 3ethoxyEthyl 2propenyl ether

データベース識別子

CAS
557-31-3
PubChem CID
11191
DTXSID
DTXSID4060319
UNII
SM8T658RE3
EC Number
209-169-7
Nikkaji
J61.531E

物性

構造計算による物性

XLogP
1.1
極性表面積
9.2 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
3
重原子数
6
形式電荷
0
複雑度
32.9

実験および物理化学的性質

Chemical Classes · 2 件

Other Classes -> Ethers, Other

Flammable agents - 3rd degree

SpringerMaterials PropertiesBoiling point
Flash Pointless than -19 °F (NFPA, 2010)
Vapor Pressure153.0 [mmHg]
Physical Description · 2 件

Allyl ethyl ether appears as a liquid. Insoluble in water and less dense than water. Hence floats on water. Emits acrid irritating fumes when heated to high temperature. Used to make other chemicals.

Liquid; [Merck Index]

物理化学的性質

融点
-140 °C · -140°C (estimate)
沸点
67 °C · 67 °C
比重(密度)
0.77 · 0.77
屈折率
1.39 · 1.39
闪点
-20 °C · -20 °C
貯蔵温度
Refrigerator
外見
clear liquid
色
Colorless to Almost colorless
比重
0.76 · 0.7600

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 · 4 件

Danger

H225 (100%): Highly Flammable liquid and vapor [Danger Flammable liquids]

P210, P233, P240, P241, P242, P243, P261, P264, P264+P265, P271, P280, P302+P352, P303+P361+P353, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P370+P378, P403+P233, P403+P235, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 45 reports by companies from 5 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

危険有害性情報

Regulatory InformationThe New Jersey Worker and Community Right to Know Act requires public and private employers to provide information about hazardous substances at their workplaces. (N.J.S.A. 34:5A-1 et. seq.)
DOT LabelFlammable Liquid Poison
Fire Hazards · 2 件

Excerpt from ERG Guide 131 [Flammable Liquids - Toxic]:

· HIGHLY FLAMMABLE: Will be easily ignited by heat, sparks or flames.

Health Hazards · 2 件

Excerpt from ERG Guide 131 [Flammable Liquids - Toxic]:

· TOXIC; may be fatal if inhaled, ingested or absorbed through skin.

Hazards Summary · 1 件

May cause skin, eye, and mucous membrane irritation; Toxic; [Merck Index] Readily oxidized by air forming unstable peroxides that may spontaneously explode; [CAMEO] May form explosive peroxides; An irritant; Toxic by ingestion and inhalation; [Alfa Aesar MSDS]

DOT ID and Guide2335 131
Reactive GroupEthers

化学と産業

用途と製造

UsesUsed to make other chemicals; [CAMEO]
General Manufacturing Information1-Propene, 3-ethoxy-: ACTIVE

応用分野

使用Allyl ethyl ether is used as an intermediate to manufacture other chemicals.

一般的な説明A liquid. Flash point below 75°F. Insoluble in water and less dense than water. Hence floats on water. Emits acrid irritating fumes when heated to high temperature. Used to make other chemicals.

上流・下流製品情報

下流製品

2-メチルこはく酸ジエチル1-クロロ-3-エトキシ-2-プロパノールエチルプロピルエーテル2-(2-プロペニル)シクロヘキサノン

関連反応

2 件
反応記録を作成
HRID 1295082 の反応式
HRID 1295082反応物としてuspto-grants-2007_07
HRID 1432816 の反応式
HRID 1432816反応物としてuspto-grants-2009_11

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
水溶解度
有機溶媒に可溶、エタノール、ジエチルエーテルと混和。水に不溶。
Merck
14 · 14,293
BRN
1361480 · 1361480
InChI
1S/C5H10O/c1-3-5-6-4-2/h3H,1,4-5H2,2H3
InChIKey
OJPSFJLSZZTSDF-UHFFFAOYSA-N
SMILES
CCOCC=C
CAS データベース
557 · 557-31-3(CAS DataBase Reference)
EPAの化学物質情報
1 · 1-Propene, 3-ethoxy- (557-31-3)

化学的性質

化学的特性Allyl ethyl ether is an extremely flammable liquid.

Reactivity Alerts
Highly Flammable
Reactivity ProfileALLYL ETHYL ETHER may react violently with strong oxidizing agents. Can act as as a base to form salts with strong acids and addition complexes with Lewis acids.
DOT Hazard Classification · 5 件

Allyl ethyl ether

UN2335

Class 3 Flammable and combustible liquid (49 eCFR § 173.120)

Class 3 Flammable and combustible liquid (49 eCFR § 173.120)

PG II: the degree of danger presented by the material is medium

Air and Water ReactionsHighly flammable. Oxidizes readily in air to form unstable peroxides that may explode spontaneously [Bretherick 1979. p.151-154, 164]. Insoluble in water and less dense than water.
Peroxide Forming Chemical · 6 件

Allyl ethyl ether

D: Other compounds that may form peroxides

Moderate peroxides found in new commerically available containers

Kelly

An explosion occured during distillation. See Bretherick's.

Anon., ABCM Quart. Safety Summ., 1963, 34, 7

安全と保護具

Fire FightingExcerpt from ERG Guide 131 [Flammable Liquids - Toxic]:
Accidental Release Measures · 2 件

· CALL 911. Then call emergency response telephone number on shipping paper. If shipping paper not available or no answer, refer to appropriate telephone number listed on the inside back cover.

· ELIMINATE all ignition sources (no smoking, flares, sparks or flames) from immediate area.

First Aid · 2 件

Excerpt from ERG Guide 131 [Flammable Liquids - Toxic]:

General First Aid:

Exposure Control and Personal Protection· Wear positive pressure self-contained breathing apparatus (SCBA).
Nonfire Spill ResponseExcerpt from ERG Guide 131 [Flammable Liquids - Toxic]:
Isolation and Evacuation · 2 件

Excerpt from ERG Guide 131 [Flammable Liquids - Toxic]:

Immediate precautionary measure

Personal Protective Equipment (PPE)Excerpt from ERG Guide 131 [Flammable Liquids - Toxic]:
Emergency Response Planning GuidelinesCAUTION: The majority of these products have a very low flash point. Use of water spray when fighting fire may be inefficient.

安全データ

F
10-23
wgk
3
tsca
TSCA listed
rtecs
KM9120000
ridadr
UN 2335
hs_code
2909199090
risk_code
11-36/37/38
消防法
危-4-1-II
hazard_code
F,Xi,T
safety_code
16-26
hazard_class
3
packing_group
II
Hazard Classifications
Eye Irrit. 2Flam. Liq. 2Skin Irrit. 2STOT SE 3
ストレージクラス
3 - Flammable liquids
危険度評価(NFPA 704基準/消防庁データ)
火災[赤]=4