(1R,2S,5R)-5-methyl-2-(propan-2-yl)cyclohexane-1-carbaldehyde
Grundinformationen
- CAS
80434-59-9- Standard-SMILES
CC(C)[C@@H]1CC[C@@H](C)C[C@H]1C=O- InChIKey
AUABNXZOGNPUSY-VWYCJHECSA-N- Summenformel
- C11H20O
- Durchschnittliche Molmasse
- 168,28 g/mol
- Monoisotopische Masse
- 168,15141526
Namen und Bezeichner
- Bevorzugter Name
- (1R,2S,5R)-5-methyl-2-(propan-2-yl)cyclohexane-1-carbaldehyde
- IUPAC
- (1R,2S,5R)-5-methyl-2-propan-2-ylcyclohexane-1-carbaldehyde
Namen und Synonyme
(1R,2S,5R)-5-methyl-2-(propan-2-yl)cyclohexane-1-carbaldehydeRefChem:393319823-031-980434-59-9(1R,2S,5R)-2-isopropyl-5-methylcyclohexanecarbaldehydeCyclohexanecarboxaldehyde, 5-methyl-2-(1-methylethyl)-, (1R,2S,5R)-(1R,2S,5R)-2-Isopropyl-5-methylcyclohexane-1-carbaldehyde(1R,2S,5R)-5-methyl-2-propan-2-ylcyclohexane-1-carbaldehydestarbld0034800SCHEMBL1859018DTXSID50460099AUABNXZOGNPUSY-VWYCJHECSA-N
Weitere Namen anzeigen
CS-0227529EN300-1709655Z1511744535
Datenbank-Bezeichner
- CAS
80434-59-9- PubChem CID
- 11252239
- DTXSID
DTXSID50460099- EC Number
- 823-031-9
- Nikkaji
- J1.857.371G
Eigenschaften
Berechnete Struktureigenschaften
- XLogP
- 3,3
- Polarare Oberfläche (TPSA)
- 17,1 Ų
- H-Brücken-Donoren
- 0
- H-Brücken-Akzeptoren
- 1
- Frei drehbare Bindungen
- 2
- Schwere Atome
- 12
- Formalladung
- 0
- Komplexität
- 151
Sicherheit und Regulatorisches
GHS-Klassifizierung
GHS Classification
Warning
H227 (100%): Combustible liquid [Warning Flammable liquids]；H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]
P210, P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P370+P378, P403, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 2 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.；Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.
Gefahrenhinweise
Hazard Classes and CategoriesFlam. Liq. 4 (100%)；Skin Irrit. 2 (100%)；Eye Irrit. 2A (100%)；STOT SE 3 (100%)
Zugehörige Reaktionen
4
Notizen zur Verbindung
Wird geladen…