2-イソプロペニル-2-オキサゾリン

2-Isopropenyl-2-oxazoline

HCID 82651

ノート反応

部分構造検索類似構造を探す

基本情報

CAS: 10471-78-0
標準SMILES: C=C(C)C1=NCCO1
InChIKey: LPIQIQPLUVLISR-UHFFFAOYSA-N
分子式: C6H9NO
平均分子量: 111.14 g/mol
単同位体質量: 111.06841391

名称と識別子

優先名称: 2-Isopropenyl-2-oxazoline
IUPAC: 2-prop-1-en-2-yl-4,5-dihydro-1,3-oxazole
現地名: 2-イソプロペニル-2-オキサゾリン
英語名: 2-Isopropenyl-2-oxazoline 99+%
分子式: C6H9NO
分子量: 111.14

名称と別名

2-Isopropenyl-2-oxazoline10471-78-0Oxazole, 4,5-dihydro-2-(1-methylethenyl)-2-(1-Methylethenyl)-4,5-dihydrooxazoleisopropenyloxazoline1222UHN97LUNII-1222UHN97LDTXSID80650862-OXAZOLINE, 2-ISOPROPENYL-RefChem:87716DTXCID70328902-prop-1-en-2-yl-4,5-dihydro-1,3-oxazole

名称をさらに表示

2-イソプロペニル-2-オキサゾリン2-Isopropenyl-2-oxazoline 99+%

MFCD034272292-(PROP-1-EN-2-YL)-4,5-DIHYDRO-1,3-OXAZOLE2-isopropenyl-4,5-dihydrooxazole2-isopropenyloxazoline4,5-dihydro-2-(prop-1-en-2-yl)oxazoleSCHEMBL164162-Isopropenyl-2-oxazoline, 98%2-Isopropenyl-4,5-dihydro-oxazole

データベース識別子

CAS: 10471-78-0
PubChem CID: 82651
DTXSID: DTXSID8065086
UNII: 1222UHN97L
EC Number: 629-206-4
Nikkaji: J24.443K

物性

構造計算による物性

XLogP: 0.8
極性表面積: 21.6 Å²
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: 1
重原子数: 8
形式電荷: 0
複雑度: 137

実験および物理化学的性質

SpringerMaterials PropertiesChemical shift

物理化学的性質

融点: 47 °C · −47 °C(lit.)
沸点: 147 °C · 147 °C(lit.)
比重(密度): 1.06 g/mL · 1.06 g/mL at 25 °C(lit.)
屈折率: 20 · n20/D 1.478(lit.)
闪点: 119 °F · 119 °F
貯蔵温度: 2 · 2-8°C
酸解離定数(Pka): 4.45 · 4.45±0.50(Predicted)
EPAの化学物質情報: 4 · Oxazole, 4,5-dihydro-2-(1-methylethenyl)- (10471-78-0)

安全と法規制

GHS分類

GHS Classification · 4 件

Danger

H226 (100%): Flammable liquid and vapor [Warning Flammable liquids]

P210, P233, P240, P241, P242, P243, P260, P261, P262, P264, P264+P265, P270, P271, P273, P280, P284, P301+P316, P301+P330+P331, P302+P352, P302+P361+P354, P303+P361+P353, P304+P340, P305+P351+P338, P305+P354+P338, P316, P317, P319, P320, P321, P330, P332+P317, P337+P317, P361+P364, P362+P364, P363, P370+P378, P391, P403+P233, P403+P235, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 143 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

危険有害性情報

Hazard Classes and CategoriesFlam. Liq. 3 (100%)

安全データ

wgk: 3
tsca: TSCA listed
ridadr: UN 3384 6.1/PG 1
risk_code: 10-23-36/37/38
hazard_code: T
safety_code: 26-36-45

化学と産業

用途と製造

General Manufacturing InformationOxazole, 4,5-dihydro-2-(1-methylethenyl)-: ACTIVE

応用分野

使用2-Isopropenyl-2-oxazoline is used to functionalize polypropylene to be used as compatibilizers for PP/(acrylonitrile-co-butadiene-co-acrylic acid) rubber (NBR) blends.