CAS 1089706-28-4 1-(5-Bromo-3-fluoro-2-hydroxyphenyl)ethan-1-one (HCID 57515846)

基本情報

CAS: 1089706-28-4
標準SMILES: CC(=O)c1cc(Br)cc(F)c1O
InChIKey: NBDDFAKYVVDWPU-UHFFFAOYSA-N
分子式: C8H6BrFO2
平均分子量: 233.03 g/mol
単同位体質量: 231.95352

名称と識別子

優先名称: 1-(5-Bromo-3-fluoro-2-hydroxyphenyl)ethan-1-one
IUPAC: 1-(5-bromo-3-fluoro-2-hydroxyphenyl)ethanone
英語名: 1-(5-bromo-3-fluoro-2-hydroxyphenyl)ethanone
分子式: C8H6BrFO2
分子量: 233.03

名称と別名

1089706-28-41-(5-bromo-3-fluoro-2-hydroxyphenyl)ethan-1-oneRefChem:426266869-580-81-(5-bromo-3-fluoro-2-hydroxyphenyl)ethanone5'-Bromo-3'-fluoro-2'-hydroxyacetophenoneMFCD16742826SCHEMBL1019833NBDDFAKYVVDWPU-UHFFFAOYSA-NPTB70628AKOS011655473AT14690

名称をさらに表示

1-(5-Bromo-3-fluoro-2-hydroxyphenyl)ethan-1-one - [B93507]

AS-92985SY191897DB-311077CS-0133078EN300-666411-(5-bromo-3-fluoro-2-hydroxy-phenyl)ethanoneEthanone, 1-(5-bromo-3-fluoro-2-hydroxyphenyl)-F621078

データベース識別子

CAS: 1089706-28-4
PubChem CID: 57515846
EC Number: 869-580-8

物性

構造計算による物性

XLogP: 2.6
極性表面積: 37.3 Å²
水素結合供与体数: 1
水素結合受容体数: 3
回転可能結合数: 1
重原子数: 12
形式電荷: 0
複雑度: 186

物理化学的性質

沸点: 268.5 · 268.5±40.0 °C(Predicted)
比重(密度): 1.667 · 1.667±0.06 g/cm3(Predicted)
貯蔵温度: RT, stored under nitrogen
酸解離定数(Pka): 8.35 · 8.35±0.23(Predicted)

安全と法規制

GHS分類

GHS Classification · 5 件

Warning

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]；H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (100%): Causes serious eye irritation [Warning 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, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

危険有害性情報

Hazard Classes and CategoriesAcute Tox. 4 (100%)；Skin Irrit. 2 (100%)；Eye Irrit. 2A (100%)；STOT SE 3 (100%)

安全データ

hs_code: 2914790090

化学と産業

サプライヤー20 社

韶远科技(上海)有限公司021-50795510 4000665055 · [email protected]

南通菡芳生物科技有限公司[email protected] 18017580634 · [email protected]

砌块化学科技（上海）有限公司021-20432219 13918097649 · [email protected]

无锡捷化医药科技有限公司83588313 18800520310 · [email protected]

上海拓目化工有限公司13391076197 · [email protected]

化合物ノート

読み込み中…