基本情報
- CAS
102292-00-2- 標準SMILES
C[N+]1(CCN=C=NC2CCCCC2)CCOCC1.Cc1ccc(S(=O)(=O)[O-])cc1- InChIKey
GBCAVSYHPPARHX-UHFFFAOYSA-M- 分子式
- C14H26N3O.C7H7O3S
- 平均分子量
- 423.6 g/mol
- 単同位体質量
- 423.21917754
名称と識別子
- 優先名称
- 1-Cyclohexyl-3-(2-morpholinoethyl)carbodiimide metho-p-toluenesulfonate
- IUPAC
- N'-cyclohexyl-N-[2-(4-methylmorpholin-4-ium-4-yl)ethyl]methanediimine;4-methylbenzenesulfonate
名称と別名
2491-17-0CME-CARBODIIMIDE1-Cyclohexyl-3-(2-morpholinoethyl)carbodiimide metho-p-toluenesulfonateCME CarbodiimideCarbodiimide, CMECMECRefChem:5113484-(2-((Cyclohexylimidocarbonyl)amino)ethyl)-4-methylmorpholinium219-650-3Morpho CDI1-Cyclohexyl-3-[2-(4-methylmorpholino)ethyl]carbodiimide p-Toluenesulfonate4-(2-(((Cyclohexylimino)methylene)amino)ethyl)-4-methylmorpholin-4-ium 4-methylbenzenesulfonate
名称をさらに表示
MFCD00011979NSC231596N-cyclohexyl-N'-(2-morpholinoethyl)carbodiimide methyl-p-toluenesulfonate1-Cyclohexyl 3-(2-morpholinoethyl)carbodiimide methotosylateCMC [N-Cyclohexyl-N''-(2-morpholinoethyl)carbodiimide metho-p-toluenesulfonate]1-cyclohexyl-3-(2-morpholinoethyl) carbodiimide metho-p-toluenesulfonateMorpho-CDI102292-00-2
データベース識別子
- CAS
102292-00-2、2491-17-0- PubChem CID
- 17220
- DTXSID
DTXSID60907344- ChEMBL
CHEMBL1789981- EC Number
- 219-650-3
物性
構造計算による物性
- 極性表面積
- 99.5 Ų
- 水素結合供与体数
- 0
- 水素結合受容体数
- 6
- 回転可能結合数
- 4
- 重原子数
- 29
- 形式電荷
- 0
- 複雑度
- 491
安全と法規制
安全情報は参考情報です。供給元の安全データシート（SDS）、適用法令、専門家による評価に代わるものではありません。
GHS分類
GHS Classification
Warning
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 39 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
危険有害性情報
Regulatory Information
Chemical: Morpholinium, 4-[2-[(cyclohexylcarbonimidoyl)amino]ethyl]-4-methyl-, salt with 4-methylbenzenesulfonic acid (1:1)
Morpholinium, 4-2-(cyclohexylcarbonimidoyl)aminoethyl-4-methyl-, salt with 4-methylbenzenesulfonic acid (1:1): Does not have an individual approval but may be used under an appropriate group standard
Other Safety InformationEvaluation - Chemicals not considered for in depth evaluation - Not commercially active in Australia
Hazard Classes and CategoriesSkin Irrit. 2 (100%)
化学と産業
用途と製造
General Manufacturing InformationMorpholinium, 4-[2-[(cyclohexylcarbonimidoyl)amino]ethyl]-4-methyl-, 4-methylbenzenesulfonate (1:1): INACTIVE
関連反応
37 件
化合物ノート
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