N,N-Dimethylallylamine (HCID 75082)

名称と識別子

優先名称: N,N-Dimethylallylamine
IUPAC: N,N-dimethylprop-2-en-1-amine
現地名: N,N-ジメチルアリルアミン
英語名: N,N-Dimethylallylamine
分子式: C5H11N
分子量: 85.15

名称と別名

N,N-Dimethylallylamine2155-94-4Allyldimethylamine2-Propen-1-amine, N,N-dimethyl-N-Allyl-N,N-dimethylamineAllylamine, N,N-dimethyl-RZ4SG99TKXNSC-32615DTXSID5062215NNDMAARefChem:161278DTXCID0036504

名称をさらに表示

N,N-ジメチルアリルアミンジメチルアリルアミンN,N-ジメチル-2-プロペン-1-アミン1-(ジメチルアミノ)-2-プロペンアリルジメチルアミンN-アリルジメチルアミン1-ジメチルアミノ-2-プロペンN，N-ジメチルプロパ-2-エン-1-アミンN,N‐ジメチルアリルアミンN,N-DimethylethenamineN-ALLYDIMETHYLAMINEN-Allyl-dimethylaminN,N-DIMETHYLALLYAMINE

218-458-7DimethylallylamineN,N-dimethylprop-2-en-1-amineN-AllyldimethylamineMFCD00038234CH2=CHCH2N(CH3)2N,N-Dimethyl-2-propene-1-amineRizatriptan Impurity 15

データベース識別子

CAS: 2155-94-4
PubChem CID: 75082
DTXSID: DTXSID5062215
UNII: RZ4SG99TKX
EC Number: 218-458-7
Nikkaji: J27.951J

物性

構造計算による物性

XLogP: 0.9
極性表面積: 3.2 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: 2
重原子数: 6
形式電荷: 0
複雑度: 39

実験および物理化学的性質

Kovats Retention Index604

物理化学的性質

融点: 59 · 59-63 °C
沸点: 62 °C · 62 °C
比重(密度): 0.719 g/mL · 0.719 g/mL at 20 °C(lit.)
屈折率: 1.4 · 1.4-1.402
闪点: 8 °C · 8 °C
貯蔵温度: 30 °C · Store below +30°C.
酸解離定数(Pka): 8.88 · 8.88±0.28(Predicted)
外見: 液体
色: 無色透明～微黄色透明
水溶解度: 溶ける
BRN: 1734044 · 1734044
安定性: 安定。強力な酸化剤と互換性がありません。
InChI: 1S/C5H11N/c1-4-5-6(2)3/h4H,1,5H2,2-3H3
InChIKey: GBCKRQRXNXQQPW-UHFFFAOYSA-N
SMILES: CN(C)CC=C || CN(C)CC=C
CAS データベース: 2155 · 2155-94-4(CAS DataBase Reference)
NISTの化学物質情報: N,N-Dimethylallyl amine(2155-94-4)
EPAの化学物質情報: 2 · 2-Propen-1-amine, N,N-dimethyl- (2155-94-4)

化学的性質

化学的特性colourless to faintly yellow liquid

安全と法規制

GHS分類

GHS Classification · 6 件

This chemical does not meet GHS hazard criteria for 70.7% (104 of 147) of all reports.

Danger

H225 (29.3%): Highly Flammable liquid and vapor [Danger Flammable liquids]；H314 (27.2%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]；H332 (27.2%): Harmful if inhaled [Warning Acute toxicity, inhalation]

P210, P233, P240, P241, P242, P243, P260, P261, P264, P271, P280, P301+P330+P331, P302+P361+P354, P303+P361+P353, P304+P340, P305+P354+P338, P316, P317, P321, P363, P370+P378, P403+P235, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 147 reports by companies from 6 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.；Reported as not meeting GHS hazard criteria per 104 of 147 reports by companies.；There are 5 notifications provided by 43 of 147 reports by companies with hazard statement code(s).；Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.

危険有害性情報

Regulatory Information · 2 件

Chemical: 2-Propen-1-amine, N,N-dimethyl-

Dimethylallylamine: Does not have an individual approval but may be used under an appropriate group standard

Hazard Classes and CategoriesFlam. Liq. 2 (29.3%)；Skin Corr. 1B (27.2%)；Acute Tox. 4 (27.2%)

法規制情報

Regulatory Information · 2 件

Chemical: 2-Propen-1-amine, N,N-dimethyl-

Dimethylallylamine: Does not have an individual approval but may be used under an appropriate group standard

安全データ

F: 10-13-34
wgk: 3
tsca: TSCA listed
ridadr: UN 2733 3/PG 2
hs_code: 29211980
risk_code: 11-20-34-36/37/38
化審法: (2)-2380
消防法: 危-4-1-II
hazard_code: F,C,Xi
safety_code: 16-26-36/37/39-45-37/39
hazard_class: 3/8
packing_group: II
Hazard Classifications: Acute Tox. 4 InhalationEye Dam. 1Flam. Liq. 2Skin Corr. 1B
ストレージクラス: 3 - Flammable liquids

化学と産業

用途と製造

General Manufacturing Information2-Propen-1-amine, N,N-dimethyl-: ACTIVE

応用分野

使用N,N-Dimethylprop-2-en-1-amine is a quaternary ammonium salts widely used to prevent microbial contamination. A useful intermediate for the preparation and flocculation performance of dimethylallyl quaternary ammonium salts of lignin.