CAS 63071-03-4 2-Methoxy-6-methylpyridine (HCID 5324773)

基本情報

CAS: 63071-03-4
標準SMILES: COc1cccc(C)n1
InChIKey: WIMNZMOEBDPZTB-UHFFFAOYSA-N
分子式: C7H9NO
平均分子量: 123.15 g/mol
単同位体質量: 123.06841391

名称と識別子

優先名称: 2-Methoxy-6-methylpyridine
IUPAC: 2-methoxy-6-methylpyridine
現地名: 2-メトキシ-6-メチルピリジン
英語名: 2-Methoxy-6-methylaminopyridine
分子式: C7H9NO
分子量: 123.15

名称と別名

2-Methoxy-6-methylpyridine63071-03-4DTXSID70415945RefChem:474496DTXCID00366794676-191-52-methoxy-6-methyl-pyridineMFCD041125072-methoxy-6-picoline6-Methoxy-2-picoline6-methoxy-2-methylpyridineSCHEMBL128704

名称をさらに表示

2-メトキシ-6-メチルピリジン2-メトキシ-6-(メチルアミノ)ピリジン6-メトキシ-2-ピコリン6-Methoxypicoline2-Methoxy-6-methyL2-Methoxy-6-methylamMethoxy-6-Methylpyrid3-Chloro-3-cyanopyridine2-Methoxy-6-methylpyridine>Pyridine, 2-methoxy-6-methyl-

SCHEMBL128705SCHEMBL491627SCHEMBL510824SCHEMBL1638184SCHEMBL47251212-Methyl-6-(methyloxy)pyridineSCHEMBL29687348AKOS006222932

データベース識別子

CAS: 63071-03-4
PubChem CID: 5324773
DTXSID: DTXSID70415945
EC Number: 676-191-5
Nikkaji: J582.098G

物性

構造計算による物性

XLogP: 1.6
極性表面積: 22.1 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: 1
重原子数: 9
形式電荷: 0
複雑度: 85

物理化学的性質

沸点: 156 · 156/759mm
比重(密度): 1.01 · 1.01
屈折率: 1.4995 · 1.4995
闪点: 156 °C · 156°C
貯蔵温度: Inert atmosphere,Room Temperature
外見: clear liquid
酸解離定数(Pka): 4.12 · 4.12±0.10(Predicted)
色: Colorless to Light yellow
水溶解度: 水にわずかに溶ける。
CAS データベース: 63071 · 63071-03-4(CAS DataBase Reference)

安全と法規制

GHS分類

GHS Classification · 5 件

Warning

H226 (100%): Flammable liquid and vapor [Warning Flammable liquids]；H302 (87.5%): Harmful if swallowed [Warning Acute toxicity, oral]；H312 (87.5%): Harmful in contact with skin [Warning Acute toxicity, dermal]；H315 (87.5%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (87.5%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H332 (87.5%): Harmful if inhaled [Warning Acute toxicity, inhalation]；H335 (25%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]

P210, P233, P240, P241, P242, P243, P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P303+P361+P353, P304+P340, P305+P351+P338, P317, P319, P321, P330, 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 8 reports by companies from 5 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. 3 (100%)；Acute Tox. 4 (87.5%)；Acute Tox. 4 (87.5%)；Skin Irrit. 2 (87.5%)；Eye Irrit. 2A (87.5%)；Acute Tox. 4 (87.5%)；STOT SE 3 (25%)