CAS 670-80-4 Morpholine, 4-(1-cyclohexen-1-yl)- (HCID 69589)

基本情報

CAS: 670-80-4
標準SMILES: C1=C(N2CCOCC2)CCCC1
InChIKey: IIQFBBQJYPGOHJ-UHFFFAOYSA-N
分子式: C10H17NO
平均分子量: 167.25 g/mol
単同位体質量: 167.13101416

名称と識別子

優先名称: Morpholine, 4-(1-cyclohexen-1-yl)-
IUPAC: 4-(cyclohexen-1-yl)morpholine
現地名: 1-モルホリノ-1-シクロヘキセン
英語名: N-(1-Cyclohexen-1-yl)morpholine
分子式: C10H17NO
分子量: 167.25

名称と別名

670-80-41-MorpholinocyclohexeneMorpholine, 4-(1-cyclohexen-1-yl)-N-Morpholino-1-cyclohexene4-(1-Cyclohexen-1-yl)morpholine4-(1-Cyclohexenyl)morpholine1-(N-Morpholino)cyclohexene1-Morpholin-1-ylcyclohexeneN-(Cyclohex-1-en-1-yl)morpholineNSC 42450EINECS 211-579-6DTXSID2060967

名称をさらに表示

1-モルホリノ-1-シクロヘキセン4-(1-シクロヘキセニル)モルホリン4-(1-シクロヘキセン-1-イル)モルホリン1-モルホリノシクロヘキセンN-(1-シクロヘキセン-1-イル)モルホリン1-(4-モルホリノ)シクロヘキセンMorpholinocyclohexene4-(cyclohex-1-en-1-yl)MorpholineBNKY018-PG03AKOS BBS-00000855Etizolam Impurity 44-cyclohexenylmorpholine

4-cyclohex-1-en-1-ylmorpholineMORPHOLINE,4-(1-CYCLOHEXENE)RefChem:819471DTXCID1044855211-579-6InChI=1/C10H17NO/c1-2-4-10(5-3-1)11-6-8-12-9-7-11/h4H,1-3,5-9H4-Cyclohex-1-enyl-morpholine1-Morpholino-1-cyclohexene

データベース識別子

CAS: 670-80-4
PubChem CID: 69589
DTXSID: DTXSID2060967
UNII: FLU852CQR2
EC Number: 211-579-6
Nikkaji: J24.511I、J714.869K

物性

構造計算による物性

XLogP: 1.7
極性表面積: 12.5 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: 12
形式電荷: 0
複雑度: 171

物理化学的性質

沸点: 118 · 118-120 °C10 mm Hg(lit.)
比重(密度): 0.995 g/mL · 0.995 g/mL at 25 °C(lit.)
屈折率: 20 · n20/D 1.514(lit.)
闪点: 155 °F · 155 °F
貯蔵温度: 2 · 2-8°C
酸解離定数(Pka): 6.33 · 6.33±0.20(Predicted)
外見: clear liquid
色: Colorless to Light yellow to Light orange
BRN: 118696 · 118696
InChI: InChI=1S/C10H17NO/c1-2-4-10(5-3-1)11-6-8-12-9-7-11/h4H,1-3,5-9H2
InChIKey: IIQFBBQJYPGOHJ-UHFFFAOYSA-N
SMILES: N1(C2CCCCC=2)CCOCC1
CAS データベース: 670 · 670-80-4(CAS DataBase Reference)
NISTの化学物質情報: 4 · Morpholine, 4-(1-cyclohexen-1-yl)-(670-80-4)
EPAの化学物質情報: 4 · Morpholine, 4-(1-cyclohexen-1-yl)- (670-80-4)

化学的性質

化学的特性CLEAR COLOURLESS TO LIGHT YELLOW LIQUID

安全と法規制

GHS分類

GHS Classification · 4 件

Warning

H315 (100%): 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 44 reports by companies from 4 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 CategoriesSkin Irrit. 2 (100%)

安全データ

F: 9
wgk: 3
tsca: TSCA listed
hs_code: 29349990
risk_code: 36/37/38
消防法: 危-4-2-III
hazard_code: Xi
safety_code: 26-36-37/39
Hazard Classifications: Eye Irrit. 2Skin Irrit. 2STOT SE 3
ストレージクラス: 10 - Combustible liquids

化学と産業

用途と製造

General Manufacturing InformationMorpholine, 4-(1-cyclohexen-1-yl)-: INACTIVE

応用分野 · 1 件

説明1-Morpholinocyclohexene (N-(1-Cyclohexen-1-yl)morpholine) falls under the category of organic compounds called morpholine class of heterocyclic amines. This colorless liquid possesses a distinct amine-like odor and displays remarkable versatility with widespread applications in multiple industries, including agrochemicals and cosmetics. Moreover, it is a valuable solvent, corrosion inhibitor, and integral component in lubricants[1].