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酪酸 ビニル

Vinyl butyrate

HCID 31247
ノート反応
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
部分構造検索類似構造を探す

基本情報

CAS
123-20-6
標準SMILES
C=COC(=O)CCC
InChIKey
MEGHWIAOTJPCHQ-UHFFFAOYSA-N
分子式
C6H10O2
平均分子量
114.14 g/mol
単同位体質量
114.06807956

概要

Vinyl butyrate, stabilized appears as a colorless liquid. Less dense than water. Vapors heavier than air. Used to make plastics and paints.

名称と識別子

優先名称
Vinyl butyrate
IUPAC
ethenyl butanoate
現地名
酪酸 ビニル
英語名
Vinyl butyrate
分子式
C6H10O2
分子量
114.14

名称と別名

Vinyl butyrate123-20-6Vinyl butanoateButanoic acid, ethenyl esterButyric acid, vinyl esterVinylester kyseliny maselnevinyl n-butyrateDW94WV9JCHNSC-5280Butanoic acid, etheyl esterDTXSID0074556RefChem:194311
名称をさらに表示
酪酸 ビニルビニルブチラート酪酸ビニルブタン酸ビニルビニル=ブチラート酪酸エテニルvinylbutanoateButyric acid vinylVINYL BUTYRATE 97%Butanoic acid vinylVinyl Butyrate VINYL BUTYRATE, STAB.Vinyl butyratesee 995032
DTXCID6033790204-609-4ethenyl butanoateVinyl butyrate, inhibitedn-Butyric acid vinyl esterVinyl Butyrate (stabilized with MEHQ)MFCD00059410Butyric Acid Vinyl Ester

データベース識別子

CAS
123-20-6
PubChem CID
31247
DTXSID
DTXSID0074556
UNII
DW94WV9JCH
EC Number
204-609-4

物性

構造計算による物性

XLogP
1.4
極性表面積
26.3 Ų
水素結合供与体数
0
水素結合受容体数
2
回転可能結合数
4
重原子数
8
形式電荷
0
複雑度
86.5

実験および物理化学的性質

Chemical ClassesFlammable agents - 3rd degree
SolventsSolvents -> Esters (<C12)
SpringerMaterials PropertiesBoiling point
Flash Point68 °F (NFPA, 2010)
Food Contact SubstancesFCS -> FDA Inventory of Food Contact Substances Listed in 21 CFR
Physical Description · 2 件

Vinyl butyrate, stabilized appears as a colorless liquid. Less dense than water. Vapors heavier than air. Used to make plastics and paints.

Colorless liquid; [CAMEO]

物理化学的性質

融点
-80 °C · -80°C
沸点
115 · 115-117°C
比重(密度)
0.899 g/mL · 0.899 g/mL at 20 °C
屈折率
20 · n20/D 1.410
闪点
20 °C · 20°C
貯蔵温度
2 · 2-8°C
水溶解度
Slightly soluble in water
外見
clear liquid

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, P271, P280, P303+P361+P353, P304+P340, P317, P370+P378, P403+P235, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 41 reports by companies from 2 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
Fire Hazards · 2 件

Excerpt from ERG Guide 129 [Flammable Liquids (Water-Miscible / Noxious); polymerization hazard]:

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

Health Hazards · 2 件

Excerpt from ERG Guide 129 [Flammable Liquids (Water-Miscible / Noxious); polymerization hazard]:

· May cause toxic effects if inhaled or absorbed through skin.

Hazards SummaryMay irritate or burn skin and eyes; Inhalation may cause dizziness or suffocation; [CAMEO] Vinyl butyrate, stabilized (UN2838) has warning of explosive polymerization. [ERG 2016]
DOT ID and Guide2838 129P
Reactive GroupEsters, Sulfate Esters, Phosphate Esters, Thiophosphate Esters, and Borate Esters
Reactivity Alerts

化学と産業

用途と製造

Uses · 2 件

Used to manufacture plastics and paints; {CAMEO]

Painting (Solvents) [Category: Paint]

応用分野 · 3 件

用途有機合成原料。

使用Vinyl Butyrate is a general chemical reagent used in the synthesis of isoxazolidines.

一般的な説明A colorless liquid. Less dense than water. Flash point 68°F. Vapors heavier than air. Used to make plastics and paints.

上流・下流製品情報

下流製品

酪酸イソアミルぎ酸ビニル(S)-(+)-2-ペンタノール(S)-(+)-2-ブタノール酪酸2-ヒドロキシエチル

サプライヤー49 社

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関連反応

14 件
反応記録を作成
HRID 217268 の反応式
HRID 217268反応物としてuspto-grants-2012_06
HRID 218864 の反応式
HRID 218864反応物としてuspto-grants-2012_06
HRID 499212 の反応式
HRID 499212反応物としてuspto-grants-2010_08
HRID 500654 の反応式
HRID 500654反応物としてuspto-grants-2010_08
HRID 657602 の反応式
HRID 657602反応物としてuspto-grants-2011_12
HRID 675726 の反応式
HRID 675726反応物としてTraining data from https://doi.org/10.1039/C8SC04228D (3/10)
HRID 886705 の反応式
HRID 886705反応物としてuspto-grants-2012_08
HRID 886706 の反応式
HRID 886706反応物としてuspto-grants-2012_08
1 / 2 ページ

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
Nikkaji
J45.693D
色
Colorless to Almost colorless
BRN
1744933 · 1744933
LogP
1.648 · 1.648 (est)
CAS データベース
123 · 123-20-6(CAS DataBase Reference)
EPAの化学物質情報
Butanoic acid, ethenyl ester (123-20-6)
Highly Flammable
Reactivity Profile · 1 件

VINYL BUTYRATE is an ester. Esters react with acids to liberate heat along with alcohols and acids. Strong oxidizing acids may cause a vigorous reaction that is sufficiently exothermic to ignite the reaction products. Heat is also generated by the interaction of esters with caustic solutions. Flammable hydrogen is generated by mixing esters with alkali metals and hydrides.

DOT Hazard Classification · 4 件

Vinyl butyrate, stabilized

UN2838

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. Slightly soluble in water.
Hazard Classes and Categories · 2 件

Flam. Liq. 2 (100%)

Flammable agents - 3rd degree, Reactive agents - 2nd degree

安全と保護具

Fire FightingExcerpt from ERG Guide 129 [Flammable Liquids (Water-Miscible / Noxious); polymerization hazard]:
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 129 [Flammable Liquids (Water-Miscible / Noxious); polymerization hazard]:

General First Aid:

Exposure Control and Personal Protection· Wear positive pressure self-contained breathing apparatus (SCBA).
Nonfire Spill ResponseExcerpt from ERG Guide 129 [Flammable Liquids (Water-Miscible / Noxious); polymerization hazard]:
Isolation and Evacuation · 2 件

Excerpt from ERG Guide 129 [Flammable Liquids (Water-Miscible / Noxious); polymerization hazard]:

Immediate precautionary measure

Personal Protective Equipment (PPE)Excerpt from ERG Guide 129 [Flammable Liquids (Water-Miscible / Noxious); polymerization hazard]:
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.

毒性情報

Adverse EffectsNeurotoxin - Acute solvent syndrome

安全データ

wgk
2
rtecs
ET7000000
ridadr
UN 2838 (VINYL BUTYRATE, STABILIZED)
hs_code
29156000
risk_code
11-20-2017/11/20
化審法
(2)-3697
消防法
危-4-1-II
hazard_code
F,Xn
safety_code
16-24/25
hazard_class
3
packing_group
II
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