テトラエチルアンモニウムフルオリド水和物

Ethanaminium, N,N,N-triethyl-, fluoride (1:1)

HCID 69582CAS 665-46-3

部分構造検索類似構造を探す

基本情報

標準SMILES: CC[N+](CC)(CC)CC.[F-]
InChIKey: QSUJAUYJBJRLKV-UHFFFAOYSA-M
分子式: C8H20FN
平均分子量: 149.25 g/mol
単同位体質量: 149.15797786

名称と識別子

優先名称: Ethanaminium, N,N,N-triethyl-, fluoride (1:1)
IUPAC: tetraethylazanium fluoride
現地名: テトラエチルアンモニウムフルオリド水和物
英語名: Tetraethylammonium fluoride dihydrate
分子式: C8H24FNO2
分子量: 185.28

名称と別名

Tetraethylammonium fluorideEthanaminium, N,N,N-triethyl-, fluoride (1:1)Ethanaminium, N,N,N-triethyl-, fluorideEINECS 211-559-7DTXSID40883253RefChem:138078DTXCID001022798Ethanaminium, N,N,Ntriethyl, fluoride211-559-7665-46-3tetraethylazanium;fluorideMFCD00011826

名称をさらに表示

テトラエチルアンモニウムフルオリド水和物N,N,N-トリエチルエタンアミニウム·フルオリドテトラエチルアンモニウム·フルオリドテトラエチルアミニウム·フルオリドテトラエチルアンモニウムフルオリドテトラエチルアンモニウムフルオリド二水和物Tetraethylazanium fluoride[E4N]FTetraethylaminium·fluorideTetraethylaMMoniuM Fluoride N,N,N-TRIETHYL-ETHANAMINIUFLUORIDEN,N,N-Triethylethanaminium·fluorideTetraethylammonium fluoride 2-hydrateTetraethylammonium fluoride dihydrateTetraethylammonium Fluoride Hydrate>

C8H20FNTETRAETHYL AMMONIUM FLUORIDEn,n,n-triethylethanaminium fluorideMethyl trioctyl ammonium fluorideEt4NFtetraethylammoniumfluoridetetraethylammonium;fluorideSCHEMBL10887

データベース識別子

CAS: 665-46-3
PubChem CID: 69582
DTXSID: DTXSID40883253
EC Number: 211-559-7

物性

構造計算による物性

極性表面積: 0 Å²
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: 4
重原子数: 10
形式電荷: 0
複雑度: 47.5

実験および物理化学的性質

Chemical ClassesNitrogen Compounds -> Quaternary Amines

Physical DescriptionDihydrate: Light beige crystalline powder; Hygroscopic; [Acros Organics MSDS]

物理化学的性質

融点: 80 °C · 80 °C (decomp)
貯蔵温度: Inert atmosphere,Room Temperature
InChI: InChI=1S/C8H20N.FH.2H2O/c1-5-9(6-2,7-3)8-4;;;/h5-8H2,1-4H3;1H;2*1H2/q+1;;;/p-1
InChIKey: HRTKQUHFGZFPPF-UHFFFAOYSA-M
SMILES: [N+](CC)(CC)(CC)CC.[F-].[H]O[H].[H]O[H]
CAS データベース: 665 · 665-46-3(CAS DataBase Reference)
EPAの化学物質情報: Tetraethylammonium fluoride (665-46-3)

安全と法規制

GHS分類

GHS Classification · 4 件

Warning

H302 (95%): Harmful if swallowed [Warning Acute toxicity, oral]

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 40 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

Hazards SummaryAn irritant; [Acros Organics MSDS] See Tetraethylammonium bromide.

Hazard Classes and CategoriesAcute Tox. 4 (95%)

安全と保護具

Exposure Control and Personal Protection · 2 件

Biological Exposure Indices (BEI) [ACGIH] - Fluorides in urine = 2 mg/L prior to shift or 3 mg/L at end of shift; (Repeated measurements recommended.)

1.0 [mg/m3], inhalable fraction, as F[German Research Foundation (DFG)]

Threshold Limit Values (TLV)2.5 [mg/m3], as F

Permissible Exposure Limit (PEL)2.5 [mg/m3], as F