CAS 654-53-5 1,2,3,4-Tetrafluoro-5-(trifluoromethyl)benzene (HCID 2733690)

基本情報

CAS: 654-53-5
標準SMILES: Fc1cc(C(F)(F)F)c(F)c(F)c1F
InChIKey: ZWVOHERGWLDGFT-UHFFFAOYSA-N
分子式: C7HF7
平均分子量: 218.07 g/mol
単同位体質量: 217.99664717

名称と識別子

優先名称: 1,2,3,4-Tetrafluoro-5-(trifluoromethyl)benzene
IUPAC: 1,2,3,4-tetrafluoro-5-(trifluoromethyl)benzene
現地名: 2,3,4,5-テトラフルオロベンゾトリフルオリド
英語名: 2,3,4,5-TETRAFLUOROBENZOTRIFLUORIDE
分子式: C7HF7
分子量: 218.07

名称と別名

654-53-51,2,3,4-tetrafluoro-5-(trifluoromethyl)benzeneDTXSID10984009RefChem:410500DTXCID1014112312,3,4,5-TETRAFLUOROBENZOTRIFLUORIDEMFCD018620132,3,4,5-tetrafluoro-benzotrifluorideSCHEMBL3687267AKOS005257994PS-100902H-Heptafluorotoluene

名称をさらに表示

2,3,4,5-テトラフルオロベンゾトリフルオリドα,α,α,2,3,4,5-ヘプタフルオロトルエン1-(トリフルオロメチル)-2,3,4,5-テトラフルオロベンゼン1,2,3,4-テトラフルオロ-5-(トリフルオロメチル)ベンゼン1,2,5,6-テトラフルオロ-4-(トリフルオロメチル)ベンゼン2,3,4,5-Tetrafluorobenzodioxeneα,α,α,2,3,4,5-Heptafluorotolueneà,à,à,2,3,4,5-heptafluorotoluene2,3,4,5-Tetrafluorobenzotrifluoride99%2,3,4,5-Tetrafluorobenzotrifluoride 99%ALPHA,ALPHA,ALPHA,2,3,4,5-HEPTAFLUORTOLUOLBenzene, 1,2,3,4-tetrafluoro-5-(trifluoromethyl)-

5-FLUORO-2-METHOXYCINNAMICACIDFT-0609345alpha,alpha,alpha,2,3,4,5-Heptafluorotoluene136820-95-6SCHEMBL1053731SCHEMBL30741240SBB095515SY049112

データベース識別子

CAS: 654-53-5
PubChem CID: 2733690
DTXSID: DTXSID10984009
EC Number: 613-798-6
Nikkaji: J2.639.418J

物性

構造計算による物性

XLogP: 3.2
極性表面積: 0 Å²
水素結合供与体数: 0
水素結合受容体数: 7
回転可能結合数: 0
重原子数: 14
形式電荷: 0
複雑度: 201

物理化学的性質

沸点: 104 °C · 104 °C
比重(密度): 1.7613 · 1.7613 (rough estimate)
屈折率: 1.3725 · 1.3725
闪点: 20.5 °C · 20.5 °C
貯蔵温度: Flammables area
外見: clear liquid
色: Colorless to Light yellow
BRN: 1973474 · 1973474
CAS データベース: 654 · 654-53-5(CAS DataBase Reference)

化学的性質

化学的特性clear colorless liquid

安全と法規制

GHS分類

GHS Classification · 5 件

Danger

H225 (20%): Highly Flammable liquid and vapor [Danger Flammable liquids]；H226 (80%): Flammable liquid and vapor [Warning Flammable liquids]；H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H335 (80%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]

P210, P233, P240, P241, P242, P243, P261, P264, P264+P265, P271, P280, P302+P352, P303+P361+P353, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P370+P378, P403+P233, P403+P235, 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 CategoriesFlam. Liq. 2 (20%)；Skin Irrit. 2 (100%)；Eye Irrit. 2 (100%)

安全データ

ridadr: 1993
hs_code: 29036990
risk_code: 36/37/38-11
消防法: 危-4-2-III
hazard_code: Xi-F,Xi
hazard_note: Irritant
safety_code: 9-37/39-33-26-16-36
hazard_class: 3
packing_group: III

化学と産業

上流・下流製品情報

上流原料

2,3,5,6-テトラフルオロベンゾトリフルオリドオクタフルオロトルエン

サプライヤー48 社

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Career Henan Chemica Co+86-0371-86658258 +86-13203830695 · [email protected]

常州新氟化学有限公司13275212658 · [email protected]

Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]

化合物ノート

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