1-Cyclohexylethylamine
Grundinformationen
- CAS
17430-98-7- Standard-SMILES
CC(N)C1CCCCC1- InChIKey
XBWOPGDJMAJJDG-UHFFFAOYSA-N- Summenformel
- C8H17N
- Durchschnittliche Molmasse
- 127,23 g/mol
- Monoisotopische Masse
- 127,13609954
Namen und Bezeichner
- Bevorzugter Name
- 1-Cyclohexylethylamine
- IUPAC
- 1-cyclohexylethanamine
- Englischer Name
- (S)-(+)-1-Cyclohexylethylamine
- Summenformel
- C8H17N
- Molmasse
- 127.23
Namen und Synonyme
1-Cyclohexylethylamine4352-49-21-(Cyclohexyl)ethylamineCyclohexanemethanamine, alpha-methyl-RefChem:4317321-Cyclohexylethanamine54423-01-7(1-cyclohexylethyl)amine1-cyclohexylethan-1-amineMFCD078095351-Cyclohexyl-1-ethanamineXBWOPGDJMAJJDG-UHFFFAOYSA-N
Weitere Namen anzeigen
(S)-1-CYCLOHEXYLETHYLAMINE(S)-1-Cyclohexylethanamine(1S)-1-Cyclohexylethanamine(S)-(+)-1-CYCLOHEXYETHYLAMINE(S)-(+)-1-CYCLOHEXYLETHYLAMINE(1S)-1-cyclohexylethan-1-amine(S)-(+)-1-AMINOETHYLCYCLOHEXANE(S)-(+)-1-CYCLOHEXYLETHYLAMINE 98%(S)-α-Methylcyclohexanemethanamine
DTXSID901371201(R)-(?)-|A-MethylcyclohexanemethylamineCyclohexanemethanamine, .alpha.-methyl-, (R)-amino-1-cyclohexylethane(1-Aminoethyl)cyclohexane1-Cyclohexyl-1-ethylamine1-amino-1-cyclohexylethaneSCHEMBL79026
Datenbank-Bezeichner
- CAS
17430-98-7、4352-49-2、54423-01-7、5913-13-3- PubChem CID
- 110733
- DTXSID
DTXSID901371201- EC Number
- 807-762-0
- Nikkaji
- J346.817H
Eigenschaften
Berechnete Struktureigenschaften
- XLogP
- 2,1
- Polarare Oberfläche (TPSA)
- 26 Ų
- H-Brücken-Donoren
- 1
- H-Brücken-Akzeptoren
- 1
- Frei drehbare Bindungen
- 1
- Schwere Atome
- 9
- Formalladung
- 0
- Komplexität
- 74,6
Physikochemische Eigenschaften
- Schmelzpunkt
- -15 °C · -15°C (estimate)
- Siedepunkt
- 60 °C/12 · 60 °C/12 mmHg (lit.)
- Dichte
- 0.856 g/mL · 0.856 g/mL at 25 °C (lit.)
- Brechungsindex
- 20 · n20/D 1.4614(lit.)
- Flammpunkt
- 126 °F · 126 °F
- storage temp.
- 2 · under inert gas (nitrogen or Argon) at 2-8°C
- Aggregatzustand
- liquid
- pka
- 10.89 · 10.89±0.29(Predicted)
- BRN
- 2935069 · 2935069
- InChI
- 1S/C8H17N/c1-7(9)8-5-3-2-4-6-8/h7-8H,2-6,9H2,1H3/t7-/m0/s1
- InChIKey
- XBWOPGDJMAJJDG-ZETCQYMHSA-N
- SMILES
- C[C@H](N)C1CCCCC1
- CAS Datenbank
- 17430 · 17430-98-7(CAS DataBase Reference)
- NIST chemische Informationen
- -1 · (S)-(+)-1-Cyclohexylethylamine(17430-98-7)
Sicherheit und Regulatorisches
GHS-Klassifizierung
GHS Classification
Danger
H226 (75%): Flammable liquid and vapor [Warning Flammable liquids]
P210, P233, P240, P241, P242, P243, P260, P261, P264, P270, P271, P280, P301+P317, P301+P330+P331, P302+P352, P302+P361+P354, P303+P361+P353, P304+P340, P305+P354+P338, P316, P317, P319, P321, P330, P362+P364, P363, P370+P378, P403+P233, P403+P235, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 4 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Gefahrenhinweise
Hazard Classes and CategoriesFlam. Liq. 3 (75%)
Sicherheitsdaten
- F
- 3-10-34
- wgk
- 3
- ridadr
- UN 2734 8/PG 2
- hs_code
- 2921.30.5000
- risk_code
- 10-34-51/53
- hazard_code
- C,N
- safety_code
- 16-26-36/37/39-45-61
- hazard_class
- 8
- packing_group
- II
- Speicherklasse
- 3 - Flammable liquids
- Hazard Classifications
- Aquatic Chronic 2Flam. Liq. 3Skin Corr. 1B
Chemie und Industrie
Anwendungen
Verwenden(S)-(+)-1-Cyclohexylethylamine may be used in the synthesis of (S)-(-)-ferrocenylimine by reacting with ferrocenecarboxaldehyde.
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