Grundinformationen
- CAS
5362-56-1- Standard-SMILES
CC(C)C=CC=O- InChIKey
RIWPMNBTULNXOH-UHFFFAOYSA-N- Summenformel
- C6H10O
- Durchschnittliche Molmasse
- 98,14 g/mol
- Monoisotopische Masse
- 98,07316494
Überblick
2-Pentenal, 4-methyl- has been reported in Plectranthus glabratus with data available.
Namen und Bezeichner
- Bevorzugter Name
- 2-Pentenal, 4-methyl-
- IUPAC
- 4-methylpent-2-enal
- Lokaler Name
- 4-Methylpent-2-enal
- Englischer Name
- 4-Methyl-2-pentenal
- Summenformel
- C6H10O
- Molmasse
- 98.14
Namen und Synonyme
Weitere Namen anzeigen
Datenbank-Bezeichner
- CAS
5362-56-1- PubChem CID
- 21458
- DTXSID
DTXSID0063816- EC Number
- 226-348-5
Eigenschaften
Berechnete Struktureigenschaften
- XLogP
- 1,3
- Polarare Oberfläche (TPSA)
- 17,1 Ų
- H-Brücken-Donoren
- 0
- H-Brücken-Akzeptoren
- 1
- Frei drehbare Bindungen
- 2
- Schwere Atome
- 7
- Formalladung
- 0
- Komplexität
- 72,2
Experimentelle und physikochemische Eigenschaften
Solubility
Slightly soluble in water; soluble in fats
soluble (in ethanol)
Physikochemische Eigenschaften
- Schmelzpunkt
- -78 °C · -78°C (estimate)
- Siedepunkt
- 70 °C · 70 °C (75 mmHg)
- Dichte
- 0.844 · 0.844
- FEMA
- 3510 · 3510 | 4-METHYL-2-PENTENAL
- Brechungsindex
- 1.436 · 1.436-1.444
- Flammpunkt
- 32 °C · 32 °C
- storage temp.
- Refrigerator (+4°C) + Flammables area
- Aggregatzustand
- Liquid
- Farbe
- Clear colorless to light yellow
- Geruch (Odor)
- 1 % · at 1.00 % in dipropylene glycol. ethereal spicy green grassy aldehydic cooked apple cognac woody
- Geruchsart
- ethereal
- JECFA Number
- 1208 · 1208
- LogP
- 1.39 · 1.39
- EPA chemische Informationen
- 2 · 2-Pentenal, 4-methyl- (5362-56-1)
Sicherheit und Regulatorisches
GHS-Klassifizierung
GHS Classification
This chemical does not meet GHS hazard criteria for 85.7% (78 of 91) of all reports.
Warning
H226 (14.3%): Flammable liquid and vapor [Warning Flammable liquids]
P210, P233, P240, P241, P242, P243, P261, P264, P271, P280, P302+P352, P303+P361+P353, P304+P340, P319, P321, P332+P317, P362+P364, P370+P378, P403+P233, P403+P235, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 91 reports by companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Gefahrenhinweise
Regulatory Information
Chemical: 2-Pentenal, 4-methyl-
Commission Regulation (EC) No 1565/2000 (Repealed by Com. Implementing Reg. (EU) No 872/2012)
2-Pentenal, 4-methyl-: Does not have an individual approval but may be used under an appropriate group standard
Sicherheitsdaten
- tsca
- TSCA listed
- hs_code
- 29121900
- risk_code
- 10
- safety_code
- 16
Chemie und Industrie
Verwendung und Herstellung
Anwendungen
OccurrenceReported found in potato chips, tomatoes, roast chicken and black tea.
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