CAS 1378388-19-2 7-((2-Bromo-5-chlorophenyl)methoxy)-1,2,3,4-tetrahydronaphthalen-1-one (HCID 69672813)

基本情報

CAS: 1378388-19-2
標準SMILES: O=C1CCCc2ccc(OCc3cc(Cl)ccc3Br)cc21
InChIKey: MMKIEEGFUOAIAU-UHFFFAOYSA-N
分子式: C17H14BrClO2
平均分子量: 365.6 g/mol
単同位体質量: 363.98657

名称と識別子

優先名称: 7-((2-Bromo-5-chlorophenyl)methoxy)-1,2,3,4-tetrahydronaphthalen-1-one
IUPAC: 7-[(2-bromo-5-chlorophenyl)methoxy]-3,4-dihydro-2H-naphthalen-1-one
現地名: 7-((2-ブロモ-5-クロロベンジル)オキシ)-3,4-ジヒドロナフタレン-1(2H)-オン
英語名: 7-[(2-Bromo-5-chlorophenyl)methoxy]-3,4-dihydro-1(2H)-naphthalenone
分子式: C17H14BrClO2
分子量: 365.65

名称と別名

1378388-19-27-[(2-bromo-5-chlorophenyl)methoxy]-1,2,3,4-tetrahydronaphthalen-1-one7-((2-Bromo-5-chlorophenyl)methoxy)-1,2,3,4-tetrahydronaphthalen-1-oneRefChem:544930696-526-97-((2-Bromo-5-chlorobenzyl)oxy)-3,4-dihydronaphthalen-1(2H)-oneMFCD30478820C17H14BrClO27-[(2-Bromo-5-chlorophenyl)methoxy]-3,4-dihydro-1(2H)-naphthalenone7-[(2-bromo-5-chlorophenyl)methoxy]-3,4-dihydro-2H-naphthalen-1-one7-(2-bromo-5-chlorobenzyloxy)-3,4-dihydronaphthalen-1(2H)-oneSCHEMBL6121177

名称をさらに表示

7-((2-ブロモ-5-クロロベンジル)オキシ)-3,4-ジヒドロナフタレン-1(2H)-オンCL1227-(2-bromo-5-chlorobenzyloxy)-1-naphthalenone7-(2-bromo-5-chlorobenzyloxy)-3,4-dihydronaphthalene-1(2H)-one1(2H)-Naphthalenone, 7-[(2-bromo-5-chlorophenyl)methoxy]-3,4-dihydro-

SCHEMBL29726325MMKIEEGFUOAIAU-UHFFFAOYSA-NAKOS030524089DS-19413DB-114024CS-0160511C725127-[(2-bromo-5-chloro-phenyl)methoxy]tetralin-1-one

物性

構造計算による物性

XLogP: 4.8
極性表面積: 26.3 Å²
水素結合供与体数: 0
水素結合受容体数: 2
回転可能結合数: 3
重原子数: 21
形式電荷: 0
複雑度: 376

物理化学的性質

沸点: 489.4 · 489.4±45.0 °C(Predicted)
比重(密度): 1.488 · 1.488±0.06 g/cm3(Predicted)
貯蔵温度: Sealed in dry,Room Temperature

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.