Grundinformationen
- CAS
61792-11-8- Standard-SMILES
CCC(C)=CCCC(C)=CC#N- InChIKey
DHJVLXVXNFUSMU-UHFFFAOYSA-N- Summenformel
- C11H17N
- Durchschnittliche Molmasse
- 163,26 g/mol
- Monoisotopische Masse
- 163,13609954
Namen und Bezeichner
- Bevorzugter Name
- 3,7-Dimethyl-2,6-nonadienenitrile
- IUPAC
- 3,7-dimethylnona-2,6-dienenitrile
- Lokaler Name
- 3,7-Dimethylnona-2,6-diennitril
- Englischer Name
- 3,7-Dimethyl-2,6-nonadienenitrile
- Summenformel
- C11H17N
- Molmasse
- 163.26
Namen und Synonyme
3,7-Dimethylnona-2,6-dienenitrileLemonile3,7-Dimethyl-2,6-nonadienenitrile2,6-Nonadienenitrile, 3,7-dimethyl-EINECS 263-214-5UNII-B8MK5EZU56B8MK5EZU56DTXSID1052296EC 263-214-5RefChem:91882DTXCID103086861792-11-8
Weitere Namen anzeigen
LemonilLemonile 65702033,7-Dimethyl-2,6-non3,7-dimethyl-6-nonadienenitrile3,7-Dimethylnona-2,6-diennitril6-Nonadienenitrile,3,7-dimethyl-2
HOMOGERANYL NITRILESCHEMBL2339773,7-dimethyl-2,6-nonadien-1-nitrileDB-073012
Datenbank-Bezeichner
- CAS
61792-11-8- PubChem CID
- 112446
- DTXSID
DTXSID1052296- EC Number
- 263-214-5
Eigenschaften
Berechnete Struktureigenschaften
- XLogP
- 3,7
- Polarare Oberfläche (TPSA)
- 23,8 Ų
- H-Brücken-Donoren
- 0
- H-Brücken-Akzeptoren
- 1
- Frei drehbare Bindungen
- 4
- Schwere Atome
- 12
- Formalladung
- 0
- Komplexität
- 225
Experimentelle und physikochemische Eigenschaften
FragrancesFragrance Ingredient (3,7-Dimethyl-2,6-nonadienenitrile) -> IFRA transparency List
Physical DescriptionCBI; Liquid
Physikochemische Eigenschaften
- Siedepunkt
- 280.37 °C · 280.37°C (rough estimate)
- Dichte
- 0.8882 · 0.8882 (rough estimate)
- Dampfdruck
- 1.7 Pa · 1.7Pa at 20℃
- Brechungsindex
- 1.46 · 1.4600 (estimate)
- Geruch (Odor)
- 10 % · at 10.00 % in dipropylene glycol. lemon cologne metallic
- Geruchsart
- citrus
- Wasserlöslichkeit
- 42 mg/L · 42mg/L at 20℃
- Kosmetik-Inhaltsstoffe Funktionen
- PERFUMING
- LogP
- 3.2 at · 3.2 at 35℃
- EPA chemische Informationen
- 2 · 2,6-Nonadienenitrile, 3,7-dimethyl- (61792-11-8)
Sicherheit und Regulatorisches
Sicherheitsangaben dienen nur zur Orientierung und ersetzen weder das Sicherheitsdatenblatt (SDB) des Lieferanten noch geltende Vorschriften oder eine fachliche Bewertung.
GHS-Klassifizierung
GHS Classification
This chemical does not meet GHS hazard criteria for 11.3% (210 of 1853) of reports.
H411 (88.7%): Toxic to aquatic life with long lasting effects [Hazardous to the aquatic environment, long-term hazard]
P273, P391, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 1853 reports by companies from 4 notifications to the ECHA C&L Inventory.
Gefahrenhinweise
Regulatory Information
Chemical: 2,6-Nonadienenitrile, 3,7-dimethyl-
2,6-Nonadienenitrile, 3,7-dimethyl- is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of 2,6-Nonadienenitrile, 3,7-dimethyl- are required to report information about their production and use of this chemical to the EPA under the Toxic Substances Control Act (TSCA). (40 eCFR Part 711)
Status: Active Update: 18-05-2023 https://echa.europa.eu/registration-dossier/-/registered-dossier/11681
2,6-Nonadienenitrile, 3,7-dimethyl-: Does not have an individual approval but may be used under an appropriate group standard
Hazard Classes and CategoriesAquatic Chronic 2 (88.7%)
Sicherheitsdaten
- tsca
- TSCA listed
Chemie und Industrie
Verwendung und Herstellung
U.S. Production2023: 400,000 - <550,000 lb
Consumer UsesOther
Industry UsesOther
Household ProductsInformation on 43 consumer products that contain 3,7-Dimethyl-2,6-nonadienenitrile in the following categories is provided:
Use ClassificationFragrance Ingredients
General Manufacturing Information
Soap, Cleaning Compound, and Toilet Preparation Manufacturing
2,6-Nonadienenitrile, 3,7-dimethyl-: ACTIVE
Anwendungen
Verwenden3,7-Dimethyl-2,6-nonadienenitrile compound in perfume for cosmetics and household products.
Anbieter37 Anbieter
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