2-フルオロ-3-(トリフルオロメチル)ベンジルアミン

2-Fluoro-3-trifluoromethylbenzylamine

HCID 2737565
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基本情報

CAS
239135-49-0
標準SMILES
NCc1cccc(C(F)(F)F)c1F
InChIKey
PQUYJDPJHOSOTN-UHFFFAOYSA-N
分子式
C8H7F4N
平均分子量
193.14 g/mol
単同位体質量
193.05146188

名称と識別子

優先名称
2-Fluoro-3-trifluoromethylbenzylamine
IUPAC
[2-fluoro-3-(trifluoromethyl)phenyl]methanamine
現地名
2-フルオロ-3-(トリフルオロメチル)ベンジルアミン
英語名
2-Fluoro-3-(trifluoromethyl)benzylamine
分子式
C8H7F4N
分子量
193.14

名称と別名

239135-49-02-fluoro-3-trifluoromethylbenzylamineDTXSID30372146RefChem:260892DTXCID903231792-Fluoro-3-(trifluoromethyl)benzylamine(2-fluoro-3-(trifluoromethyl)phenyl)methanamine[2-fluoro-3-(trifluoromethyl)phenyl]methanamineMFCD00061161[2-fluoro-3-(trifluoromethyl)phenyl]methylamineBenzenemethanamine, 2-fluoro-3-(trifluoromethyl)-1-[2-FLUORO-3-(TRIFLUOROMETHYL)PHENYL]METHANAMINE
名称をさらに表示
2-フルオロ-3-(トリフルオロメチル)ベンジルアミン2-フルオロ-3-(トリフルオロメチル)ベンジルアミン, 97%RARECHEM AL BW 05372-Fluoro-3-trifluoromethylbenzylami2-Fluoro-3-(trifluoromethyl)benzylamine97%2-Fluoro-3-(trifluoromethyl)benzylamine 97%
SCHEMBL41932SCHEMBL41933CL8678SBB091541AKOS005256288CS-W010694FF85119PS-8319

データベース識別子

CAS
239135-49-0
PubChem CID
2737565
DTXSID
DTXSID30372146
EC Number
671-883-3

物性

構造計算による物性

XLogP
1.8
極性表面積
26 Ų
水素結合供与体数
1
水素結合受容体数
5
回転可能結合数
1
重原子数
13

物理化学的性質

沸点
193 °C · 193°C
比重(密度)
1 · 1,321 g/cm3
屈折率
1.4548 · 1.4548
闪点
83 °C · 83°C
貯蔵温度
Store under nitrogen
酸解離定数(Pka)
8.27 · 8.27±0.10(Predicted)

安全と法規制

GHS分類

GHS Classification · 5 件

Danger

H314 (80%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]；H315 (20%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (20%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H335 (20%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]

P260, P261, P264, P264+P265, P271, P280, P301+P330+P331, P302+P352, P302+P361+P354, P304+P340, P305+P351+P338, P305+P354+P338, P316, P319, P321, P332+P317, P337+P317, P362+P364, P363, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 5 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 CategoriesSkin Irrit. 2 (20%)；Eye Irrit. 2 (20%)；STOT SE 3 (20%)

安全データ

ridadr
2735
hs_code
2921490090
risk_code
34-36/37/38
hazard_code
C,Xi
hazard_note
Corrosive/Store under nitrogen
safety_code
26-36/37/39-45-36

化学と産業

応用分野

使用2-Fluoro-3-(trifluoromethyl)benzylamine is an important raw material and intermediate used in organic synthesis, pharmaceuticals and agrochemicals.

サプライヤー66 社

阿诺西（上海）生物技术有限公司400-1107768 15058188853 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
陕西缔都新材料有限公司81124267 17392282731 · [email protected]
Career Henan Chemica Co+86-0371-86658258 +86-13203830695 · [email protected]
上海莉凯化工技术有限公司16628776521 · [email protected]

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