CAS 90902-84-4 2,5-Dibromopyridin-3-amine (HCID 19387532)

基本情報

CAS: 90902-84-4
標準SMILES: Nc1cc(Br)cnc1Br
InChIKey: VHGBUYMPBFPXQM-UHFFFAOYSA-N
分子式: C5H4Br2N2
平均分子量: 251.91 g/mol
単同位体質量: 249.87412

名称と識別子

優先名称: 2,5-Dibromopyridin-3-amine
IUPAC: 2,5-dibromopyridin-3-amine
現地名: 3-アミノ-2,5-ジブロモピリジン
英語名: 2,5-DIBROMO-3-AMINOPYRIDINE
分子式: C5H4Br2N2
分子量: 251.91

名称と別名

2,5-Dibromopyridin-3-amine90902-84-42,5-dibromo-3-pyridinamineDTXSID20598590RefChem:444251DTXCID60549349804-617-33-Amino-2,5-dibromopyridine2,5-Dibromo-pyridin-3-ylamine2,5-Dibromo-3-aminopyridineMFCD092662243-PYRIDINAMINE, 2,5-DIBROMO-

名称をさらに表示

3-アミノ-2,5-ジブロモピリジン2,5-ジブロモ-ピリジン-3-イルアミン3-Amino-2,5-dibromopyridi...3-Amino-2,5-dibromopyridine≥ 98% (HPLC)2,5-DIBROMO-3-AMINOPYRIDINE ISO 9001：2015 REACH

SCHEMBL202631AKOS015835793SY041992EN300-1070272,5-dibromopyridin-3-ylamineFT-0657535A843669HS-3

データベース識別子

CAS: 90902-84-4
PubChem CID: 19387532
DTXSID: DTXSID20598590
EC Number: 804-617-3

物性

構造計算による物性

XLogP: 1.9
極性表面積: 38.9 Å²
水素結合供与体数: 1
水素結合受容体数: 2
回転可能結合数: 0
重原子数: 9
形式電荷: 0
複雑度: 99

物理化学的性質

融点: 152 to · 152.0 to 156.0 °C
沸点: 325 · 325.0±37.0 °C(Predicted)
比重(密度): 2.147 · 2.147±0.06 g/cm3(Predicted)
貯蔵温度: Keep in dark place,Sealed in dry,Room Temperature
酸解離定数(Pka): -0.56 · -0.56±0.10(Predicted)
外見: powder to crystal
色: White to Brown
InChI: InChI=1S/C5H4Br2N2/c6-3-1-4(8)5(7)9-2-3/h1-2H,8H2
InChIKey: VHGBUYMPBFPXQM-UHFFFAOYSA-N
SMILES: C1(Br)=NC=C(Br)C=C1N
CAS データベース: 90902 · 90902-84-4

化学的性質

化学的特性Brown solid

安全と法規制

GHS分類

GHS Classification · 5 件

Danger

H301 (95%): Toxic if swallowed [Danger Acute toxicity, oral]；H318 (95%): Causes serious eye damage [Danger Serious eye damage/eye irritation]

P264, P264+P265, P270, P280, P301+P316, P305+P354+P338, P317, P321, P330, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 40 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.

危険有害性情報

Hazard Classes and CategoriesAcute Tox. 3 (95%)；Eye Dam. 1 (95%)

安全データ

wgk: 3
ridadr: UN 2811 6.1 / PGIII
hs_code: 2933399990
risk_code: 25-41
hazard_code: Xi,T
safety_code: 26-39-45
hazard_class: IRRITANT
Hazard Classifications: Acute Tox. 3 OralEye Dam. 1
ストレージクラス: 6.1C - Combustible acute toxic Cat.3toxic compounds or compounds which causing chronic effects