4'-メチルビフェニル-4-オール

4-(4-Methylphenyl)phenol

HCID 1382789

ノート反応

部分構造検索類似構造を探す

基本情報

CAS: 26191-64-0
標準SMILES: Cc1ccc(-c2ccc(O)cc2)cc1
InChIKey: DDZACMDGXVXOOH-UHFFFAOYSA-N
分子式: C13H12O
平均分子量: 184.23 g/mol
単同位体質量: 184.088815

名称と識別子

優先名称: 4-(4-Methylphenyl)phenol
IUPAC: 4-(4-methylphenyl)phenol
現地名: 4'-メチルビフェニル-4-オール
英語名: 4'-Methyl[1,1'-biphenyl]-4-ol
分子式: C13H12O
分子量: 184.23

名称と別名

4'-Methyl[1,1'-Biphenyl]-4-Ol4-(4-methylphenyl)phenol4'-Methyl(1,1'-biphenyl)-4-olRefChem:514423607-882-126191-64-04'-Methyl-[1,1'-biphenyl]-4-ol4'-methyl-1,1'-biphenyl-4-ol4'-methylbiphenyl-4-olMFCD002188024-Hydroxy-4'-methylbiphenyl[1,1'-Biphenyl]-4-ol, 4'-methyl-

名称をさらに表示

4-(4-メチルフェニル)フェノール4'-メチルビフェニル-4-オール4-(p-トリル)フェノール4'-メチル[1,1'-ビフェニル]-4-オール4-ヒドロキシ-4'-メチルビフェニル4'-メチル-1,1'-ビフェニル-4-オールAURORA 4245AKOS BAR-10564-(p-Tolyl)phenol1,1'-Biphenyl]-4-ol, 4'-methyl-1-Methyl-4-phenylcyclohexa-2,4-dien-1-ol

4'-methyl-4-biphenylol4'-methyl-biphenyl-4-olDTXSID00362559CS-W007015AB01330941-02Z568990674-methyl-biphenyl-4-ol4'-methyl-4-h

データベース識別子

CAS: 26191-64-0
PubChem CID: 1382789
DTXSID: DTXSID00362559
EC Number: 607-882-1
Nikkaji: J161.446K

物性

構造計算による物性

XLogP: 3.6
極性表面積: 20.2 Å²
水素結合供与体数: 1
水素結合受容体数: 1
回転可能結合数: 1
重原子数: 14
形式電荷: 0
複雑度: 162

物理化学的性質

融点: 150 · 150-152°C
沸点: 318.6 · 318.6±11.0 °C(Predicted)
比重(密度): 1.087 · 1.087±0.06 g/cm3(Predicted)
貯蔵温度: Sealed in dry,Room Temperature
酸解離定数(Pka): 9.92 · 9.92±0.26(Predicted)
外見: solid
色: Grey

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]；H411 (100%): Toxic to aquatic life with long lasting effects [Hazardous to the aquatic environment, long-term hazard]

P261, P264, P264+P265, P270, P271, P273, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P391, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 2 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.