1-ヨード-4-フェノキシベンゼン

4-Iododiphenyl ether

HCID 520399CAS 2974-94-9

部分構造検索類似構造を探す

基本情報

標準SMILES: Ic1ccc(Oc2ccccc2)cc1
InChIKey: BDKOUDYNKRCDEC-UHFFFAOYSA-N
分子式: C12H9IO
平均分子量: 296.1 g/mol
単同位体質量: 295.96981

名称と識別子

優先名称: 4-Iododiphenyl ether
IUPAC: 1-iodo-4-phenoxybenzene
現地名: 1-ヨード-4-フェノキシベンゼン
英語名: 4-Iododiphenyl ether
分子式: C12H9IO
分子量: 296.1

名称と別名

4-Iododiphenyl etherRefChem:524254675-843-61-Iodo-4-phenoxybenzene2974-94-91-Iodo-4-phenoxy-benzeneBenzene, 1-iodo-4-phenoxy-MFCD000606664-Phenoxyphenyl iodide4-iodophenyl phenyl ether4-phenoxyiodobenzene4,4'-iododiphenyl ether

名称をさらに表示

4-ヨードジフェニルエーテル4-フェノキシフェニルヨージドフェニル(4-ヨードフェニル)エーテル1-ヨード-4-フェノキシベンゼン4-ヨード(1,1′-オキシビスベンゼン)4-ヨードフェニルフェニルエーテル4-iodiphenyl etherp-PhenoxyiodobenzenePhenyl iodophenyl ether4-Iodophenyl phenyletherBenzene,1-iodo-4-phenoxy-1-iodo-4-(2-phenoxyphenyl)benzene

SCHEMBL46981-Iodo-4-phenoxybenzene #SCHEMBL45734824-iododiphenyl ether, AldrichCPRDTXSID00334337AKOS015964702AB91861FS-3945

データベース識別子

CAS: 2974-94-9
PubChem CID: 520399
DTXSID: DTXSID00334337
EC Number: 675-843-6
Nikkaji: J323.620J

物性

構造計算による物性

XLogP: 4.9
極性表面積: 9.2 Å²
水素結合供与体数: 0
水素結合受容体数: 1
回転可能結合数: 2
重原子数: 14
形式電荷: 0
複雑度: 158

物理化学的性質

融点: 43 · 43~45℃
沸点: 105 · 105-115 °C(Press: 0.01 Torr)
比重(密度): 1.626 · 1.626±0.06 g/cm3(Predicted)
貯蔵温度: 2 · 2-8°C(protect from light)

安全と法規制

GHS分類

GHS Classification · 5 件

Warning

H315 (66.7%): Causes skin irritation [Warning Skin corrosion/irritation]；H317 (33.3%): May cause an allergic skin reaction [Warning Sensitization, Skin]；H319 (66.7%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H335 (66.7%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]

P261, P264, P264+P265, P271, P272, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P333+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 3 reports by companies from 3 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.