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1,2-Diaminocyclohexane, cis-
(1R,2S)-cyclohexane-1,2-diaMine · cis< · Compound Fr14224 · (2-aminocyclohexyl)amine · cis-1,2-Cyclohexandiamine · CIS-1,2-CYCLOHEXANEDIAMINE · CIS-1,2-DIAMINOCYCLOHEXANE · meso-1,2-Cyclohexanediamine
Identifikatoren & physikalische Daten
| CAS No. | 1436-59-5 |
|---|---|
| Summenformel | C6H14N2 |
| Durchschnittliche Molmasse | 114,19 g/mol |
| Monoisotopische Masse | 114,11569845 g/mol |
| SMILES | N[C@@H]1CCCC[C@@H]1N |
| InChIKey | SSJXIUAHEKJCMH-OLQVQODUSA-N |
| PubChem CID | 342917 |
| EC No. | 604-372-0 |
| DTXSID | DTXSID501311027 |
Chemische & physikalische Eigenschaften
| XLogP | -0,3 |
|---|---|
| Polarare Oberfläche (TPSA) | 52 |
| H-Brücken-Donoren | 2 |
| H-Brücken-Akzeptoren | 2 |
| Frei drehbare Bindungen | 0 |
| Schwere Atome | 8 |
| Formalladung | 0 |
| Komplexität | 62,9 |
| Schmelzpunkt | 8°C |
| Siedepunkt | 92-93 °C/18 mmHg (lit.) |
| Dichte | 0.952 g/mL at 25 °C (lit.) |
| Dampfdruck | 0.4 mm Hg ( 20 °C) |
| Brechungsindex | n20/D 1.493(lit.) |
| Flammpunkt | 161 °F |
| Lagerbedingungen | Keep in dark place,Inert atmosphere,Room temperature |
| Löslichkeit | Completely miscible in water |
| Aggregatzustand | Low Melting Solid |
| pKa (Säurekonstante) | 9.93(at 20℃) |
| Farbe | Brown |
| InChI | InChI=1/C6H14N2/c7-5-3-1-2-4-6(5)8/h5-6H,1-4,7-8H2/t5-,6+ |
| InChIKey | SSJXIUAHEKJCMH-OLQVQODUSA-N |
| SMILES | [C@@H]1(N)CCCC[C@@H]1N |&1:0,6,r| |
| CAS Datenbank | 1436-59-5(CAS DataBase Reference) |
| NIST chemische Informationen | cis-1,2-Cyclohexanediamine(1436-59-5) |
Sicherheit & Vorschriften
| GHS-Einstufung | DangerH314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]P260, P264, P280, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P321, P363, P405, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 44 reports by companies from 5 notifications to the ECHA C&L Inventory. |
|---|---|
| Regulatorische Informationen | Status: Active Update: 12-12-2017 https://echa.europa.eu/registration-dossier/-/registered-dossier/21661 |
| Hazard Classes and Categories | Skin Corr. 1B (100%) |
| F | 10-34 |
| Wassergefährdungsklasse (WGK) | 3 |
| UN-Transportnummer | UN 2735 8/PG 2 |
| Zollcode | 29213000 |
| R-Sätze (R) | 34 |
| Gefahrensymbole | C |
| Sicherheitshinweise (S) | 26-36/37/39-45 |
| Gefahrenklasse | 8Eye Dam. 1Skin Corr. 1B |
| Verpackungsgruppe | II |
| Lagerklasse | 8A - Combustible corrosive hazardous materials |
Anwendungen & Verwendung
Verwenden
cis-1,2-Diaminocyclohexane was used in the synthesis of platinum complexes that have high antitumor activity.It was also used in the synthesis of multidentate ligands for uranyl and transition metal complexation.