6-Octen-3-one, 2,4,4,7-tetramethyl-
Grundinformationen
- CAS
74338-72-0- Standard-SMILES
CC(C)=CCC(C)(C)C(=O)C(C)C- InChIKey
CTLDWNVYXLHMAS-UHFFFAOYSA-N- Summenformel
- C12H22O
- Durchschnittliche Molmasse
- 182,3 g/mol
- Monoisotopische Masse
- 182,16706532
Namen und Bezeichner
- Bevorzugter Name
- 6-Octen-3-one, 2,4,4,7-tetramethyl-
- IUPAC
- 2,4,4,7-tetramethyloct-6-en-3-one
- Englischer Name
- 6-Octen-3-one, 2,4,4,7-tetramethyl-
- Summenformel
- C12H22O
- Molmasse
- 182.3
Namen und Synonyme
6-Octen-3-one, 2,4,4,7-tetramethyl-74338-72-02,4,4,7-tetramethyl-6-octen-3-oneEC 422-520-0DTXSID9072789claritoneRefChem:544130DTXCID8047634422-520-0687-587-22,4,4,7-tetramethyloct-6-en-3-one2,4,4,7-tetramethyl-oct-6-en-3-one
Weitere Namen anzeigen
SCHEMBL81453NS00004389
Datenbank-Bezeichner
- CAS
74338-72-0- PubChem CID
- 9815427
- DTXSID
DTXSID9072789- EC Number
- 422-520-0、687-587-2
- Nikkaji
- J1.977.540B
Eigenschaften
Berechnete Struktureigenschaften
- XLogP
- 3,8
- Polarare Oberfläche (TPSA)
- 17,1 Ų
- H-Brücken-Donoren
- 0
- H-Brücken-Akzeptoren
- 1
- Frei drehbare Bindungen
- 4
- Schwere Atome
- 13
- Formalladung
- 0
- Komplexität
- 205
Experimentelle und physikochemische Eigenschaften
FragrancesFragrance Ingredient (2,4,4,7-Tetramethyl-6-octen-3-one) -> IFRA transparency List
Physikochemische Eigenschaften
- Siedepunkt
- 239.7 · 239.7±9.0 °C(Predicted)
- Dichte
- 0.837 · 0.837±0.06 g/cm3(Predicted)
- Geruch (Odor)
- 100 % · at 100.00 %. sweet herbal clary sage bergamot petitgrain tropical citrus
- Geruchsart
- herbal
- LogP
- 3.67 · 3.670
- EPA chemische Informationen
- 6 · 6-Octen-3-one, 2,4,4,7-tetramethyl- (74338-72-0)
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
Warning
H315: Causes skin irritation [Warning Skin corrosion/irritation]
P264, P273, P280, P302+P352, P321, P332+P317, P362+P364, P391, and P501 (click each P-code to see the statement)
Warning
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
P264, P273, P280, P302+P352, P321, P332+P317, P362+P364, P391, and P501 (click each P-code to see the statement)
Gefahrenhinweise
Regulatory Information
Chemical: 6-Octen-3-one, 2,4,4,7-tetramethyl-
PMN - indicates a commenced PMN (Pre-Manufacture Notices) substance.
REACH registered substance: 2,4,4,7-tetramethyl-6-octen-3-one (EC: 422-520-0)
6-Octen-3-one, 2,4,4,7-tetramethyl-: Does not have an individual approval but may be used under an appropriate group standard
Hazard Classes and Categories
Skin Irrit. 2 (100%)
Skin Irrit. 2 (100%)
Skin irritation - category 2
Skin Irrit. 2
Sicherheitsdaten
- tsca
- TSCA listed
- risk_code
- 38-51/53
- hazard_code
- Xi,N
- safety_code
- 37-61
Chemie und Industrie
Verwendung und Herstellung
IFRA Fragrance Standards
2,4,4,7-Tetramethyl-6-octen-3-one
2,4,4,7-Tetramethyl-6-octen-3-one; Claritone (commercial name)
IFRA_STD_224.pdf
51
IFRA 51st Amendment - Guidance for the use of IFRA Standards
Restriction: This material should be used only in the limited quantity as stated in the Standard
Use ClassificationFragrance Ingredients
General Manufacturing Information6-Octen-3-one, 2,4,4,7-tetramethyl-: ACTIVE
Restriction Limits in the Finished Product (%)
0.34 [Products applied to the lips]
0.10 [Products applied to the axillae]
2.0 [Products applied to the face/body using fingertips]
1.9 [Products related to fine fragrances]
0.48 [Products applied to the body using the hands (palms), primarily leave-on (Body lotion)]
0.48 [Products applied to the face using the hands (palms), primarily leave-on (Face moisturizer)]
Anbieter4 Anbieter
湖北世腾化工科技有限公司19086915685 18971850150 · [email protected]
湖北东曹化学科技有限公司027-83238443 13343438265 · [email protected]
XIAMEN AMITY INDUSTRY AND TRADE CO., LTD.+8618950047208 · [email protected]
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
Zugehörige Reaktionen
1
Notizen zur Verbindung
Wird geladen…