1-Cyclohexyl-3-(2-morpholinoethyl)carbodiimide metho-p-toluenesulfonate

HCID 17220

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Grundinformationen

CAS: 102292-00-2
Standard-SMILES: C[N+]1(CCN=C=NC2CCCCC2)CCOCC1.Cc1ccc(S(=O)(=O)[O-])cc1
InChIKey: GBCAVSYHPPARHX-UHFFFAOYSA-M
Summenformel: C14H26N3O.C7H7O3S
Durchschnittliche Molmasse: 423,6 g/mol
Monoisotopische Masse: 423,21917754

Namen und Bezeichner

Bevorzugter Name: 1-Cyclohexyl-3-(2-morpholinoethyl)carbodiimide metho-p-toluenesulfonate
IUPAC: N'-cyclohexyl-N-[2-(4-methylmorpholin-4-ium-4-yl)ethyl]methanediimine;4-methylbenzenesulfonate

Namen und Synonyme

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

Weitere Namen anzeigen

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

Datenbank-Bezeichner

CAS: 102292-00-2、2491-17-0
PubChem CID: 17220
DTXSID: DTXSID60907344
ChEMBL: CHEMBL1789981
EC Number: 219-650-3

Eigenschaften

Berechnete Struktureigenschaften

Polarare Oberfläche (TPSA): 99,5 Å²
H-Brücken-Donoren: 0
H-Brücken-Akzeptoren: 6
Frei drehbare Bindungen: 4
Schwere Atome: 29
Formalladung: 0
Komplexität: 491

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 4 Einträge

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.

Gefahrenhinweise

Regulatory Information · 2 Einträge

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%)