2,3-ジアミノ-6-メトキシピリジン HYDROCHLORIDE

2,3-Diamino-6-methoxypyridine

HCID 3023920CAS 28020-38-4

部分構造検索類似構造を探す

基本情報

標準SMILES: COc1ccc(N)c(N)n1
InChIKey: WEPOCTWSRWLQLL-UHFFFAOYSA-N
分子式: C6H9N3O
平均分子量: 139.16 g/mol
単同位体質量: 139.07456192

名称と識別子

優先名称: 2,3-Diamino-6-methoxypyridine
IUPAC: 6-methoxypyridine-2,3-diamine
現地名: 2,3-ジアミノ-6-メトキシピリジン HYDROCHLORIDE
英語名: 2,3-Diamino-6-methoxypyridine
分子式: C6H9N3O
分子量: 139.16

名称と別名

6-methoxypyridine-2,3-diamine2,3-Diamino-6-methoxypyridine2,3-Pyridinediamine, 6-methoxy-6-METHOXY-2,3-PYRIDINEDIAMINE6-METHOXY-2,3-DIAMINOPYRIDINEPyridine, 2,3-diamino-6-methoxy-UNII-VGV76K138FVGV76K138FDTXSID80388570RefChem:81544DTXCID00208125858-385-3

名称をさらに表示

2,3-ジアミノ-6-メトキシピリジン HYDROCHLORIDE2,3-ジアミノ-6-メトキシピリジン二塩酸塩2,3-ジアミノ-6-メトキシピリジンTENA-0022,3-diamino-6-methoxpyridine2,3-DIAMINO-6-METHOXYPYRIDINE HCL2,3-Diamino-6-methoxypyridine Hydrochlor2,3-DIAMINO-6-METHOXYPYRIDINE HYDROCHLORIDE2,3-Diamino-6-methoxypyridine hydrochloride 98%6-methoxypyridine-2,3-diamine2,3-diamino-6-methoxypyridine6-Methoxy-pyridin-2,3-diamine2,3-diamino-6-methoxy-pyridine

28020-38-4MFCD06658229SCHEMBL126903SCHEMBL294248446-methoxy-pyridine-2,3-diamineWEPOCTWSRWLQLL-UHFFFAOYSA-N6-(Methyloxy)-2,3-pyridinediamineAKOS006282278

データベース識別子

CAS: 28020-38-4
PubChem CID: 3023920
DTXSID: DTXSID80388570
UNII: VGV76K138F
EC Number: 858-385-3
Nikkaji: J313.756B

物性

構造計算による物性

XLogP: 0.1
極性表面積: 74.2 Å²
水素結合供与体数: 2
水素結合受容体数: 4
回転可能結合数: 1
重原子数: 10
形式電荷: 0
複雑度: 109

物理化学的性質

融点: 168 · 168-170°C
沸点: 321.7 · 321.7±37.0 °C(Predicted)
比重(密度): 1.251 · 1.251±0.06 g/cm3(Predicted)
貯蔵温度: 2 · 2-8°C(protect from light)
酸解離定数(Pka): 4.55 · 4.55±0.50(Predicted)
CAS データベース: 28020 · 28020-38-4(CAS DataBase Reference)

安全と法規制

GHS分類

GHS Classification · 5 件

Warning

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

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

The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.