Formamide, N-(2-phenylethyl)- (HCID 140995)

名称と識別子

優先名称: Formamide, N-(2-phenylethyl)-
IUPAC: N-(2-phenylethyl)formamide
現地名: N-フェネチルホルムアミド
英語名: Formamide, N-(2-phenylethyl)-
分子式: C9H11NO
分子量: 149.19

名称と別名

23069-99-0Formamide, N-(2-phenylethyl)-N-Formylphenylethylamine2-Phenylethylformamide(2-Phenethyl)formamideNSC 18966Formamide, N-phenethyl-,N-(2-Phenethyl)formamideDTXSID70177637RefChem:141211DTXCID30100128NOOOMJZHMKSKBF-UHFFFAOYSA-N

名称をさらに表示

N-(2-フェニルエチル)ホルムアミドN-フェネチルホルムアミドフェネチルアミノホルムアルデヒドN-FormylphenethylamineN-benzenethylcarboxamideN-formyl-1-phenethylamineN-(β-Phenylethyl)formamide

N-phenethylformamideN-(2-Phenylethyl)formamideN-PHENETHYL-FORMAMIDE(2-Phenylethyl)formamidephenethylformamideMFCD00962346phenylethylformamideN-formyl-2-phenylethanamine

データベース識別子

CAS: 23069-99-0
PubChem CID: 140995
DTXSID: DTXSID70177637
EC Number: 663-749-8
Nikkaji: J28.433E

物性

構造計算による物性

XLogP: 1.5
極性表面積: 29.1 Å²
水素結合供与体数: 1
水素結合受容体数: 1
回転可能結合数: 3
重原子数: 11
形式電荷: 0
複雑度: 108

実験および物理化学的性質

Kovats Retention Index1487.2

物理化学的性質

沸点: 180 · 180-181 °C(Press: 14 Torr)
比重(密度): 1.049 g/mL · 1.049 g/mL at 25 °C
屈折率: 20 · n20/D1.546
闪点: 110 ℃ · >110℃
貯蔵温度: -20 °C · -20°C
酸解離定数(Pka): 16.04 · 16.04±0.23(Predicted)
外見: liquid
InChI: 1S/C9H11NO/c11-8-10-7-6-9-4-2-1-3-5-9/h1-5,8H,6-7H2,(H,10,11)
InChIKey: NOOOMJZHMKSKBF-UHFFFAOYSA-N
SMILES: O=CNCCc1ccccc1

安全と法規制

GHS分類

GHS Classification · 5 件

Danger

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]；H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]；H317 (100%): May cause an allergic skin reaction [Warning Sensitization, Skin]；H318 (100%): Causes serious eye damage [Danger Serious eye damage/eye irritation]；H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]

P261, P264, P264+P265, P270, P271, P272, P280, P301+P317, P302+P352, P304+P340, P305+P354+P338, P317, P319, P321, P330, P332+P317, P333+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 39 reports by companies from 2 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 CategoriesAcute Tox. 4 (100%)；Skin Irrit. 2 (100%)；Skin Sens. 1 (100%)；Eye Dam. 1 (100%)；STOT SE 3 (100%)

安全データ

wgk: 3
ridadr: 2810
risk_code: 22-37/38-41-43
hazard_code: Xn
safety_code: 26-36/37/39
hazard_class: 6.1(b)
packing_group: III
Hazard Classifications: Acute Tox. 4 OralEye Dam. 1Skin Irrit. 2Skin Sens. 1STOT SE 3
ストレージクラス: 10 - Combustible liquids

化学と産業

応用分野

使用Reactant for:Preparation of allenamides by alkylation with propargyl bromide and isomerizationUgi 3CC reaction

上流・下流製品情報

上流原料

ビス(3-フェニルプロピル)アミン N-ホルミルエチルアミンけい皮酸ニトリルイソシアン酸フェネチルメタノールぎ酸 carbon monoxide 炭素ジオンホルマリン N-メチルホルムアミドぎ酸メチルフェニルアセトニトリル

下流製品

フェニルエチルイソシアニド 3,4-ジヒドロイソキノリン

サプライヤー23 社

毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]

上海腾准生物科技有限公司19821570922 · [email protected]

上海毕得医药科技股份有限公司400-1647117 13681763483 · [email protected]

苏州市森菲达化工有限公司18796480002 18796480002 · [email protected]

焦作沃恩生物科技有限责任公司0391-3702345 18739121806

N-フェネチルホルムアミド

基本情報