CAS 123333-84-6 Lithium diisopropylamide mono(tetrahydrofuran) (HCID 10997623)

基本情報

CAS: 123333-84-6
標準SMILES: C1CCOC1.CC(C)[N-]C(C)C.[Li+]
InChIKey: YTJXGDYAEOTOCG-UHFFFAOYSA-N
分子式: C10H22LiNO
平均分子量: 179.3 g/mol
単同位体質量: 179.18614387

名称と識別子

優先名称: Lithium diisopropylamide mono(tetrahydrofuran)
IUPAC: lithium;di(propan-2-yl)azanide;oxolane
現地名: リチウムジイソプロピルアミドモノ(テトラヒドロフラン) 溶液
英語名: Lithium diisopropylamide mono(tetrahydrofuran)
分子式: C6H15N.C4H8O.Li
分子量: 180.24

名称と別名

LITHIUM DIISOPROPYLAMIDE MONO(TETRAHYDROFURAN)116912-61-9lithium;di(propan-2-yl)azanide;oxolaneLDA THFLDA.THFlithiumdiisopropylamide THFlithium diisopropylamide THFSCHEMBL304794DTXSID30924467lithiumdiisopropylamide tetrahydrofuranAKOS015910965lithium diisopropylamide tetrahydorfuran

名称をさらに表示

リチウムジイソプロピルアミドモノ(テトラヒドロフラン) 溶液di(propan-2-yl)azanideLITHIUM DIISOPROPYLAMIDE MONO THFLITHIUM DIISOPROPYLAMIDE MONO-THF COMPLEXLithium diisopropylamide mono(tetrahydrofuran) solutionLITHIUM DIISOPROPYLAMIDE MONO(TETRAHYDRO -FURAN), 1.5M SOLN. IN CYCLOHEXANE2-Propanamine, N-(1-methylethyl)-, lithium salt, compd. with tetrahydrofuran (1:1)2-Propanamine, N-(1-methylethyl)-, lithium salt, compd. with tetrahydrofuran (1:1:1)LithiuM diisopropylaMide Mono(tetrahydrofuran), 1.5M solution in cyclohexane, AcroSeal

lithium diisopropylamide tetrahydrofuranlithium diisopropylamide monotetrahydrofuranDB-230583Lithium diisopropylamide mono tetrahydrofuranlithiumdiisopropylamide mono(tetrahydrofuran)lithium diisopropylamide mono (tetrahydrofuran)Lithium N-(propan-2-yl)propan-2-aminide--oxolane (1/1/1)Lithium, [N-(1-methylethyl)-2-propanaminato](tetrahydrofuran)-

データベース識別子

CAS: 123333-84-6
PubChem CID: 10997623
DTXSID: DTXSID30924467
EC Number: 629-624-7

物性

構造計算による物性

極性表面積: 10.2 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: 2
重原子数: 13
形式電荷: 0
複雑度: 60.6

物理化学的性質

比重(密度): 0.816 g/mL · 0.816 g/mL at 25 °C
蒸気密度: 1 · >1 (vs air)
闪点: 1 °F · −1 °F
貯蔵温度: 2 · 2-8°C
外見: 液体
色: オレンジ
InChI: 1S/C6H14N.C4H8O.Li/c1-5(2)7-6(3)4;1-2-4-5-3-1;/h5-6H,1-4H3;1-4H2;/q-1;;+1
InChIKey: YTJXGDYAEOTOCG-UHFFFAOYSA-N
SMILES: [Li+].C1CCOC1.CC(C)[N-]C(C)C
CAS データベース: 123333 · 123333-84-6

安全と法規制

GHS分類

GHS Classification · 4 件

Danger

H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]

P260, P264, P280, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P321, P363, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 39 reports by companies from 1 notifications to the ECHA C&L Inventory.

危険有害性情報

Hazard Classes and CategoriesSkin Corr. 1B (100%)

安全データ

F: 1-10
wgk: 2
ridadr: UN 2924 3/PG 2
risk_code: 45-46-11-34-67-65-50/53-48/20
hazard_code: F,T,N,C
safety_code: 53-16-26-27-36/37/39-45-62-61-60
Hazard Classifications: Aquatic Acute 1Aquatic Chronic 1Asp. Tox. 1Eye Dam. 1Flam. Liq. 2Skin Corr. 1BSTOT RE 2STOT SE 3
ストレージクラス: 3 - Flammable liquids

化学と産業

応用分野 · 1 件

使用Lithium diisopropylamide mono(tetrahydrofuran) can be used:As an initiator in the anionic polymerization ofD,L-lactide.In one of the key synthetic steps for the preparation of phenylacetic acid component of muscarinic M3receptor antagonist.In the synthesis of new sexithiophene derivatives, which are used as electron donor materials in bilayer photovoltaic devices.