2,6-Pyridinedimethanol (HCID 70957)

名称と識別子

優先名称: 2,6-Pyridinedimethanol
IUPAC: [6-(hydroxymethyl)-2-pyridinyl]methanol
現地名: 2,6-ピリジンジメタノール
英語名: 2,6-Pyridinedimethanol
分子式: C7H9NO2
分子量: 139.15

名称と別名

2,6-Pyridinedimethanol1195-59-1Pyridine-2,6-diyldimethanolDTXSID20152474RefChem:870724DTXCID1074965214-803-0[6-(hydroxymethyl)pyridin-2-yl]methanol2,6-Bis(hydroxymethyl)pyridine2,6-DIHYDROXYMETHYLPYRIDINEMFCD0000635126-Pyridinedimethanol

名称をさらに表示

2,6-ピリジンジメタノール2,6-ビス(ヒドロキシメチル)ピリジン2,6‐ピリジンジメタノール2,6-ピリジンジイルビス(メタノール)ピリジン-2,6-ビス(メタノール)2,6-ジメタノールピリジン[6-(ヒドロキシメチル)ピリジン-2-イル]メタノールピリジン-2,6-ジメタノール(ピリジン-2,6-ジイル)ビスメタノールピリジン-2,6-ビスメタノール2,6-ピリジンビスメタノール(6-ヒドロキシメチルピリジン-2-イル)メタノール(6-Hydroxymethyl-pyridin-2-yl)-methanol2,6-PYRIDINETHANOL2,6-PYRIDINEMETHANOL BIS2,6-Pyridinedimethanol ,98%2,6-PyridinediMethanol, 98% 5GR2,6-PyridinediMethanol SynonyMs 2,6-PyridyldicarbinolRARECHEM AL BD 0203

Pyridine-2,6-dimethanol[6-(hydroxymethyl)-2-pyridyl]methanol2,6-Bis-(hydroxymethyl)pyridine[6-(hydroxymethyl)-2-pyridyl]methan-1-ol(2,6-PYRIDINYL)DIMETHANOLpyridine 2,6-dimethanol(Pyridine-2,6-diyl)dimethanol2,6-bis-(hydroxymethyl)-pyridine

データベース識別子

CAS: 1195-59-1
PubChem CID: 70957
DTXSID: DTXSID20152474
EC Number: 214-803-0
Nikkaji: J41.162K

物性

構造計算による物性

XLogP: -0.8
極性表面積: 53.4 Å²
水素結合供与体数: 2
水素結合受容体数: 3
回転可能結合数: 2
重原子数: 10
形式電荷: 0
複雑度: 87

物理化学的性質

融点: 112 · 112-114 °C (lit.)
沸点: 185 °C · 185°C 15mm
比重(密度): 1.1997 · 1.1997 (rough estimate)
屈折率: 1.48 · 1.4800 (estimate)
闪点: 185 °C/15mm · 185°C/15mm
貯蔵温度: Inert atmosphere,Room Temperature
酸解離定数(Pka): 13.03 · 13.03±0.10(Predicted)
外見: 結晶性粉末
色: ライトイエローからベージュ
水溶解度: 水に溶ける。
BRN: 116016 · 116016
InChI: InChI=1S/C7H9NO2/c9-4-6-2-1-3-7(5-10)8-6/h1-3,9-10H,4-5H2
InChIKey: WWFMINHWJYHXHF-UHFFFAOYSA-N
SMILES: C1(CO)=NC(CO)=CC=C1
CAS データベース: 1195 · 1195-59-1(CAS DataBase Reference)
NISTの化学物質情報: 2 · Pyridine, 2,6-dicarbinol(1195-59-1)

化学的性質

化学的特性light yellow to beige crystalline powder

安全と法規制

GHS分類

GHS Classification · 5 件

Danger

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]；H318 (96.1%): Causes serious eye damage [Danger Serious eye damage/eye irritation]；H335 (96.1%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P354+P338, P317, P319, P321, P332+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 51 reports by companies from 7 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

Regulatory InformationStatus: Active Update: 01-10-2020 https://echa.europa.eu/registration-dossier/-/registered-dossier/31701

Hazard Classes and CategoriesSkin Irrit. 2 (100%)；Eye Dam. 1 (96.1%)；STOT SE 3 (96.1%)

法規制情報

Regulatory InformationStatus: Active Update: 01-10-2020 https://echa.europa.eu/registration-dossier/-/registered-dossier/31701

安全データ

F: 23
wgk: 3
hs_code: 29333999
risk_code: 37/38-41-36/37/38
hazard_code: Xi
hazard_note: Irritant
safety_code: 26-39-24/25-36
Hazard Classifications: Eye Dam. 1Skin Irrit. 2STOT SE 3
ストレージクラス: 11 - Combustible Solids

化学と産業

応用分野

使用2,6-Pyridinedimethanol can be used as a quantum dot solution for photoelectric device and biomedicine and also a ligand to synthesize a variety of metal complexes and catalysts.