3-アミノピリダジン

Aminopyridazine

HCID 230373CAS 5469-70-5
部分構造検索類似構造を探す

基本情報

標準SMILES
Nc1cccnn1
InChIKey
LETVJWLLIMJADE-UHFFFAOYSA-N
分子式
C4H5N3
平均分子量
95.1 g/mol
単同位体質量
95.04834717

名称と識別子

優先名称
Aminopyridazine
IUPAC
pyridazin-3-amine
現地名
3-アミノピリダジン
英語名
Pyridazin-3-amine
分子式
C4H5N3
分子量
95.1

名称と別名

aminopyridazineRefChem:4977873-Aminopyridazinepyridazin-3-amine5469-70-53-PYRIDAZINAMINEpyridazin-3-ylamineMFCD01529869imino-pyridazinePyridazine, 3-amino-(Pyridazin-3-yl)amineNSC25228
名称をさらに表示
3-アミノピリダジン3-ピリダジンアミンピリダジン-3-アミン3‐アミノピリダジンピリダジン-3-イルアミンPyridazine-3-amine2-AMINOPYRIDAZINEPyridazin-2-amine3-Amino pyradizine3-amino-1,2-diazine
NSC-25228YQP8QA3E57CHEMBL5170155BCP22422BP-21190AM20100349XGVpyridazineamine

データベース識別子

CAS
5469-70-5
PubChem CID
230373
DTXSID
DTXSID30282256
ChEMBL
CHEMBL5170155
UNII
YQP8QA3E57
EC Number
639-365-1
Nikkaji
J81.045B

物性

構造計算による物性

XLogP
-1.2
極性表面積
51.8 Ų
水素結合供与体数
1
水素結合受容体数
3
回転可能結合数
0
重原子数
7

物理化学的性質

融点
171 °C · 171 °C
沸点
326.2 · 326.2±15.0 °C(Predicted)
比重(密度)
1.216 · 1.216±0.06 g/cm3(Predicted)
貯蔵温度
Keep in dark place,Sealed in dry,Room Temperature
溶解性
soluble in Methanol
酸解離定数(Pka)
4.88 · 4.88±0.10(Predicted)

化学的性質

化学的特性White to yellow to light brown powder or crystal

安全と法規制

GHS分類

GHS Classification · 5 件

Warning

H302 (91.3%): Harmful if swallowed [Warning Acute toxicity, oral]；H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]

P264, P264+P265, P270, P280, P301+P317, P305+P351+P338, P330, P337+P317, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 46 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 CategoriesAcute Tox. 4 (91.3%)；Eye Irrit. 2A (100%)

安全データ

wgk
3
hs_code
29339900
risk_code
22-36
hazard_code
Xi,Xn
safety_code
26-24/25
hazard_class
IRRITANT

化学と産業

応用分野

使用It is an important raw material and intermediate used in organic synthesis, pharmaceuticals, agrochemicals and dyestuffs.

上流・下流製品情報

サプライヤー50 社

梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
VladaChem GmbH+49-7246-3082843 +86-18411632868 · [email protected]
T&W GROUP021-61551611 13296011611 · [email protected]
爱斯特（成都）生物制药股份有限公司+86-28-85122536 85324413 · [email protected]

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