1,2-Ethanediamine, 4-methylbenzenesulfonate (1:?)

HCID 225030CAS 14034-59-4

基本情報

標準SMILES: Cc1ccc(S(=O)(=O)O)cc1.NCCN
InChIKey: HVCCFMAPGCBCHZ-UHFFFAOYSA-N
分子式: C9H16N2O3S
平均分子量: 232.3 g/mol

名称と識別子

優先名称: 1,2-Ethanediamine, 4-methylbenzenesulfonate (1:?)
IUPAC: ethane-1,2-diamine;4-methylbenzenesulfonic acid

名称と別名

Ethylenediamine p-toluenesulphonate7294-10-2RefChem:4118421,2-Ethanediamine, 4-methylbenzenesulfonate (1:?)230-728-6DTXSID10109465114034-59-4ethylenediamine p-toluenesulfonateEthane-1,2-diamine 4-methylbenzenesulfonateXylometazoline EP Impurity Eethane-1,2-diamine;4-methylbenzenesulfonic acidEC 810-688-1

名称をさらに表示

1,2-Ethanediamine 4-methylbenzenesulfonate (1:1)NSC 14086EThane-1,2-diamine x4-methylbenzenesulfonateethylene diamine mono-p-toluenesulfonic acid salt1,2-Ethanediamine, 4-methylbenzenesulfonate (1:1)Ethane-1,2-diamine Mono(4-methylbenzenesulphonate)ethylenediamine monotosylateNSC14086

データベース識別子

CAS: 14034-59-4、7294-10-2
PubChem CID: 225030
EC Number: 230-728-6、810-688-1

物性

構造計算による物性

極性表面積: 115 Å²
水素結合供与体数: 3
水素結合受容体数: 5
回転可能結合数: 2
重原子数: 15
形式電荷: 0
複雑度: 212

安全と法規制

GHS分類

GHS Classification · 4 件

Warning

H228 (100%): Flammable solid [Danger Flammable solids]

P210, P240, P241, P264, P264+P265, P270, P280, P301+P317, P302+P352, P305+P351+P338, P321, P330, P332+P317, P337+P317, P362+P364, P370+P378, 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.