CAS 1121-58-0 4-(Methylamino)pyridine (HCID 123098)

名称と識別子

優先名称: 4-(Methylamino)pyridine
IUPAC: N-methylpyridin-4-amine
現地名: 4-(メチルアミノ)ピリジン
英語名: N-Methyl-4-pyridinamine
分子式: C6H8N2
分子量: 108.14

名称と別名

1121-58-04-(Methylamino)pyridine4-Methylaminopyridine4-MampDTXSID50149913RefChem:525514DTXCID3072404628-413-7N-methylpyridin-4-amineN-Methyl-4-pyridinamine4-Pyridinamine, N-methyl-MFCD00152625

名称をさらに表示

4-(メチルアミノ)ピリジン4-メチルアミノピリジン4-(メチルアミノ)ピリジン, 99%N-メチルピリジン-4-アミンN-メチル-4-ピリジンアミンmethyl(4-pyridyl)amineFampridine Impurity 269Methyl-pyridin-4-yl-aminePyridine, 4-(methylamino)-4-Methylaminopyridine ,99%

Pyridine, 4-methylamino-pyridin-4yl-methylaminepyridin-4-yl-methylamine4-(methylamino) pyridineN-Methyl-4-aminopyridine4-(N-Methylamino)pyridine4-(n-methylamino)-pyridineSCHEMBL84825

データベース識別子

CAS: 1121-58-0
PubChem CID: 123098
DTXSID: DTXSID50149913
ChEMBL: CHEMBL5426680
EC Number: 628-413-7
Nikkaji: J595.380D

物性

構造計算による物性

XLogP: 0.8
極性表面積: 24.9 Å²
水素結合供与体数: 1
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: 57

物理化学的性質

融点: 124 · 124-125 °C (lit.)
沸点: 100 °C/0.1 · 100 °C/0.1 mmHg (lit.)
比重(密度): 1.0275 · 1.0275 (estimate)
屈折率: 1.556 · 1.5560 (estimate)
貯蔵温度: 2 · 2-8°C, protect from light
溶解性: soluble in Methanol
外見: powder to crystal
酸解離定数(Pka): 1 · pK1:9.65(+1) (20°C)
色: White to Almost white
水溶解度: 水、アセトン、エタノール、エーテル、ベンゼンに可溶。
BRN: 108213 · 108213
InChI: InChI=1S/C6H8N2/c1-7-6-2-4-8-5-3-6/h2-5H,1H3,(H,7,8)
InChIKey: LSCYTCMNCWMCQE-UHFFFAOYSA-N
SMILES: C1=NC=CC(NC)=C1
CAS データベース: 1121 · 1121-58-0(CAS DataBase Reference)
NISTの化学物質情報: -4 · N-Methyl-4-pyridinamine(1121-58-0)

安全と法規制

GHS分類

GHS Classification · 5 件

Warning

H302 (10.6%): Harmful if swallowed [Warning Acute toxicity, oral]；H312 (10.6%): Harmful in contact with skin [Warning Acute toxicity, dermal]；H315 (97.9%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (97.9%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H332 (10.6%): Harmful if inhaled [Warning Acute toxicity, inhalation]；H335 (95.7%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]

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 47 reports by companies from 6 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.；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

Hazard Classes and CategoriesSkin Irrit. 2 (97.9%)；Eye Irrit. 2 (97.9%)；STOT SE 3 (95.7%)

安全データ

F: 34
wgk: 3
ridadr: 2811
hs_code: 29333990
risk_code: 36/37/38
hazard_code: Xi
safety_code: 26-36
hazard_class: 6.1
packing_group: III
Hazard Classifications: Eye Irrit. 2Skin Irrit. 2STOT SE 3
ストレージクラス: 11 - Combustible Solids

化学と産業

応用分野

使用N-Methyl-4-pyridinamine is used in the synthesis of novel pan-PIM kinase inhibitors.

上流・下流製品情報

上流原料

4-ブロモピリジン塩酸塩メチルアミン炭酸カリウムクロロホルム

下流製品

4-(MethylaMino)piperidine Cyanomethyl methyl(4-pyridyl)carbamodithioate N-methyl-N-pyridin-4-ylpyridine-4-carboxamide

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化合物ノート

読み込み中…

4-(メチルアミノ)ピリジン

基本情報