Grundinformationen
- CAS
22457-23-4- Standard-SMILES
CCC(CC(C)CC)=NO- InChIKey
CBVWMGCJNPPAAR-UHFFFAOYSA-N- Summenformel
- C8H17NO
- Durchschnittliche Molmasse
- 143,23 g/mol
- Monoisotopische Masse
- 143,13101417
Namen und Bezeichner
- Bevorzugter Name
- 3-Methyl-5-heptanone oxime
- IUPAC
- N-(5-methylheptan-3-ylidene)hydroxylamine
- Lokaler Name
- 5-Methylheptan-3-onoxim
- Englischer Name
- 5-Methyl-3-heptanone oxime
- Summenformel
- C8H17NO
- Molmasse
- 143.23
Namen und Synonyme
5-Methylheptan-3-one oximeStemone5-Methyl-3-heptanone oxime22457-23-43-Heptanone, 5-methyl-, oxime3-Methyl-5-heptanone oximeEthyl 2-methylbutyl ketoximeEthyl 2-methylbutyl ketoxineEINECS 245-010-8XHN6C9A7U3NSC 166310BRN 1923529
Weitere Namen anzeigen
Stemon[R]leafy oximeStemone 90235015-Methylheptan-3-onoximMethyl-3-heptanoneoxime5-methyl-3-heptanonoxime3-Methyl-5-heptanoneoximeETHYL METHYLBUTYL KETOXIME
NSC-166310RefChem:503972N-(5-methylheptan-3-ylidene)hydroxylamineUNII-XHN6C9A7U35-methyl-heptan-3-one oximeSCHEMBL113135DTXSID9051874N-(5-Methyl-3-heptanylidene)hydroxylamine
Datenbank-Bezeichner
- CAS
22457-23-4- PubChem CID
- 90787
- DTXSID
DTXSID9051874- UNII
- XHN6C9A7U3
- EC Number
Eigenschaften
Berechnete Struktureigenschaften
- XLogP
- 2,5
- Polarare Oberfläche (TPSA)
- 32,6 Ų
- H-Brücken-Donoren
- 1
- H-Brücken-Akzeptoren
- 2
- Frei drehbare Bindungen
- 4
- Schwere Atome
- 10
- Formalladung
- 0
- Komplexität
- 110
Experimentelle und physikochemische Eigenschaften
FragrancesFragrance Ingredient (5-Methyl-3-heptanone oxime) -> IFRA transparency List
Physical DescriptionLiquid; CBI
Physikochemische Eigenschaften
- Siedepunkt
- 261.35 °C · 261.35°C (rough estimate)
- Dichte
- 0.9636 · 0.9636 (rough estimate)
- Dampfdruck
- 5.32 Pa · 5.32Pa at 20℃
- Brechungsindex
- 1.4614 · 1.4614 (estimate)
- pka
- 12.42 · 12.42±0.10(Predicted)
- Geruch (Odor)
- 100 % · at 100.00 %. galbanum fig leaf green weedy cortex
- Geruchsart
- green
- Wasserlöslichkeit
- 1.06 g/L · 1.06g/L at 20℃
- Kosmetik-Inhaltsstoffe Funktionen
- FRAGRANCEPERFUMING
- InChI
- InChI=1S/C8H17NO/c1-4-7(3)6-8(5-2)9-10/h7,10H,4-6H2,1-3H3
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 18.3% (302 of 1648) of reports.
Warning
H319 (78.3%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]
P264+P265, P280, P305+P351+P338, and P337+P317 (click each P-code to see the statement)
Aggregated GHS information provided per 1648 reports by companies from 6 notifications to the ECHA C&L Inventory.
Gefahrenhinweise
Regulatory Information
Chemical: 3-Heptanone, 5-methyl-, oxime
3-Heptanone, 5-methyl-, oxime is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of 3-Heptanone, 5-methyl-, oxime 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)
REACH registered substance: 5-methylheptan-3-one oxime (EC: 245-010-8)
3-Heptanone, 5-methyl-, oxime: Does not have an individual approval but may be used under an appropriate group standard
Hazard Classes and CategoriesEye Irrit. 2 (78.3%)
Sicherheitsdaten
- tsca
- TSCA listed
Chemie und Industrie
Verwendung und Herstellung
U.S. Production2023: 100,000 - <250,000 lb
Consumer UsesFragrance
Industry UsesFragrance
Household ProductsInformation on 7 consumer products that contain Ethyl Methylbutyl Ketoxime in the following categories is provided:
Use ClassificationFragrance Ingredients
General Manufacturing Information
Soap, Cleaning Compound, and Toilet Preparation Manufacturing
3-Heptanone, 5-methyl-, oxime: ACTIVE
Anwendungen
VerwendenStemone is a compound that has a leafy, green, fresh odour, and is commonly used in perfume formulations.
Anbieter51 Anbieter
江西益众化工有限公司15307925109 15350027073 · [email protected]
南京凯美西化工有限公司02558748998 18951874644 · [email protected]
Hebei Chuanghai Biotechnology Co., Ltd+86-17732866630 · [email protected]
Hebei Zhuanglai Chemical Trading Co Ltd+86-16264648883 · [email protected]
陕西缔都新材料有限公司029-63373950 17392216152 · [email protected]
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