1-メチル-4-ピペリジンメタンアミン

1-Methylpiperidine-4-methylamine

HCID 81574CAS 7149-42-0

部分構造検索類似構造を探す

基本情報

標準SMILES: CN1CCC(CN)CC1
InChIKey: AGTPSAZJSOQXHJ-UHFFFAOYSA-N
分子式: C7H16N2
平均分子量: 128.22 g/mol
単同位体質量: 128.13134852

名称と識別子

優先名称: 1-Methylpiperidine-4-methylamine
IUPAC: (1-methylpiperidin-4-yl)methanamine
現地名: 1-メチル-4-ピペリジンメタンアミン
英語名: (1-Methyl-4-piperidinyl)methanamine
分子式: C7H16N2
分子量: 128.22

名称と別名

1-Methylpiperidine-4-methylamineEINECS 230-477-2DTXSID50221708NSC 72092RefChem:434662DTXCID40144199230-477-27149-42-0(1-methylpiperidin-4-yl)methanamine(1-methyl-4-piperidinyl)methanamine1-methyl-piperidin-4-methylamine4-(aminomethyl)-1-methylpiperidine

名称をさらに表示

1-メチル-4-ピペリジンメタンアミン1‐メチル‐4‐ピペリジンメタンアミン(1-メチル-4-ピペリジニル)メタンアミン1-(1-メチルピペリジン-4-イル)メタンアミン4-(アミノメチル)-1-メチルピペリジン(1-メチル-4-ピペリジニル)メタンアミドAKOS B025002BUTTPARK 145\06-16TIMTEC-BB SBB009719ART-CHEM-BB B025002CHEMBRDG-BB 41030031-Methyl-4-(aMinoMethyl)p...(1-METHYL-4-PIPERIDINYL)METHAN

4-piperidinemethanamine, 1-methyl-MFCD050224301-Methyl-4-(aminomethyl)piperidine1-(1-methylpiperidin-4-yl)methanamine4-aminomethyl-1-methylpiperidineC-(1-Methyl-piperidin-4-yl)-methylamineCHEMBL4536092NSC-72092

データベース識別子

CAS: 7149-42-0
PubChem CID: 81574
DTXSID: DTXSID50221708
ChEMBL: CHEMBL4536092
UNII: SN4T9RA4WM
EC Number: 230-477-2
Nikkaji: J227.406J

物性

構造計算による物性

XLogP: 0.1
極性表面積: 29.3 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: 9
形式電荷: 0
複雑度: 75

物理化学的性質

融点: 0 °C · 0°C
沸点: 80 °C · 80 °C
比重(密度): 0.901 · 0.901±0.06 g/cm3(Predicted)
闪点: 0 °C · 0°C
貯蔵温度: Keep in dark place,Sealed in dry,Room Temperature
外見: liquid
酸解離定数(Pka): 10.13 · 10.13±0.29(Predicted)
色: Pale yellow
InChI: InChI=1S/C7H16N2/c1-9-4-2-7(6-8)3-5-9/h7H,2-6,8H2,1H3
InChIKey: AGTPSAZJSOQXHJ-UHFFFAOYSA-N
SMILES: N1(C)CCC(CN)CC1
CAS データベース: 7149 · 7149-42-0(CAS DataBase Reference)

化学的性質

化学的特性Colourless liquid

安全と法規制

GHS分類

GHS Classification · 5 件

Danger

H226 (88.9%): Flammable liquid and vapor [Warning Flammable liquids]；H302 (93.3%): Harmful if swallowed [Warning Acute toxicity, oral]；H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]

P210, P233, P240, P241, P242, P243, P260, P264, P270, P280, P301+P317, P301+P330+P331, P302+P361+P354, P303+P361+P353, P304+P340, P305+P354+P338, P316, P321, P330, P363, P370+P378, P403+P235, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 45 reports by companies from 8 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 CategoriesFlam. Liq. 3 (88.9%)；Acute Tox. 4 (93.3%)；Skin Corr. 1C (100%)

安全データ

wgk: 1
ridadr: 2735
hs_code: 29333990
risk_code: 34-20/22-22-10
hazard_code: C,Xi
hazard_note: Corrosive
safety_code: 26-36/37/39-45-23
hazard_class: IRRITANT
Hazard Classifications: Acute Tox. 4 OralEye Dam. 1Flam. Liq. 3Skin Corr. 1C
ストレージクラス: 3 - Flammable liquids

化学と産業

応用分野

使用(1-methyl-4-piperidinyl)methanamine is a reagent used in the synthesis of novel indole-carboxamides which are inhibitors of neurotropic alphavirus.

上流・下流製品情報

上流原料

イソニペコタミドホルマリンニッケルパラジウム塩化スルフィニル 1-メチルピペリジン-4-カルボオキサミドテトラヒドロフラン水素化リチウムアルミニウム

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Sichuan Biosynce Pharmatech Co., Ltd.[email protected]

陕西缔都新材料有限公司029-63373950 17392216152 · [email protected]