Methyl-2-hexyl-3-oxocyclopentancarboxylat
Methyl hexyl cyclopentanone carboxylate
Grundinformationen
- CAS
37172-53-5- Standard-SMILES
CCCCCCC1C(=O)CCC1C(=O)OC- InChIKey
IPWBXORAIBJDDQ-UHFFFAOYSA-N- Summenformel
- C13H22O3
- Durchschnittliche Molmasse
- 226,31 g/mol
- Monoisotopische Masse
- 226,15689456
Namen und Bezeichner
- Bevorzugter Name
- Methyl hexyl cyclopentanone carboxylate
- IUPAC
- methyl 2-hexyl-3-oxocyclopentane-1-carboxylate
- Lokaler Name
- Methyl-2-hexyl-3-oxocyclopentancarboxylat
- Englischer Name
- Methyl 2-Hexyl-3-oxocyclopentanecarboxylate
- Summenformel
- C13H22O3
- Molmasse
- 226.31
Namen und Synonyme
37172-53-5Methyl 2-hexyl-3-oxocyclopentanecarboxylate2JE1P6GLJFCyclopentanecarboxylic acid, 2-hexyl-3-oxo-, methyl esterPFW DIHYDRO ISOJASMONATEDTXSID5052048METHYL HEXYL CYCLOPENTANONE CARBOXYLATERefChem:817775DTXCID0030615METHYL HEXYL CYCLOPENTANONE CARBOXYLATE [INCI]253-379-1Dihydrojasmonate
Weitere Namen anzeigen
DIHYDROISOJASMONATEXOVERT HIGH IMPACTRUBARBUS HIGH IMPACTTROPALONE HIGH IMPACTDIHYDRO ISOJASMONATE(TM)Methyldihydroisojasmonatedihydroisojasmonate methyl esterMethyl (2-amyl-3-oxocyclopentyl)acetate
methyl 2-hexyl-3-oxocyclopentane-1-carboxylate2-HEXYL-3-OXO-CYCLOPENTANECARBOXYLIC ACID, METHYL ESTERDihydro isojasmonateUNII-2JE1P6GLJFEINECS 253-379-12-n-Hexy-3-methoxycarbonylcyclopentanoneSCHEMBL1142972-Hexyl-3-oxocyclopentanecarboxylic acid, methyl ester
Eigenschaften
Berechnete Struktureigenschaften
- XLogP
- 3
- Polarare Oberfläche (TPSA)
- 43,4 Ų
- H-Brücken-Donoren
- 0
- H-Brücken-Akzeptoren
- 3
- Frei drehbare Bindungen
- 7
- Schwere Atome
- 16
- Formalladung
- 0
- Komplexität
- 248
Physikochemische Eigenschaften
- Siedepunkt
- 308.6 · 308.6±35.0 °C(Predicted)
- Dichte
- 0.999 · 0.999±0.06 g/cm3(Predicted)
- Dampfdruck
- 0.042 Pa · 0.042Pa at 20℃
- Geruch (Odor)
- 100 % · at 100.00 %. green jasmin floral fresh oily herbal
- Geruchsart
- floral
- Wasserlöslichkeit
- 186 mg/L · 186mg/L at 20.1℃
- Kosmetik-Inhaltsstoffe Funktionen
- PERFUMINGFRAGRANCETONIC
- LogP
- 3.2 at · 3.2 at 22℃
- EPA chemische Informationen
- 2 · Cyclopentanecarboxylic acid, 2-hexyl-3-oxo-, methyl ester (37172-53-5)
Sicherheit und Regulatorisches
GHS-Klassifizierung
GHS Classification
This chemical does not meet GHS hazard criteria for 92.3% (1525 of 1652) of all reports.
Not Classified；Reported as not meeting GHS hazard criteria by 1525 of 1652 companies (only 7.7% companies provided GHS information). For more detailed information, please visit ECHA C&L website.
Aggregated GHS information provided per 1652 reports by companies from 4 notifications to the ECHA C&L Inventory.；Reported as not meeting GHS hazard criteria per 1525 of 1652 reports by companies.；There are 3 notifications provided by 127 of 1652 reports by companies with hazard statement code(s).；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
Regulatory Information
Chemical: Cyclopentanecarboxylic acid, 2-hexyl-3-oxo-, methyl ester
Status: Active Update: 25-06-2020 https://echa.europa.eu/registration-dossier/-/registered-dossier/28081
Cyclopentanecarboxylic acid, 2-hexyl-3-oxo-, methyl ester: Does not have an individual approval but may be used under an appropriate group standard
Hazard Classes and CategoriesNot Classified
Regulatorische Informationen
Regulatory Information
Chemical: Cyclopentanecarboxylic acid, 2-hexyl-3-oxo-, methyl ester
Status: Active Update: 25-06-2020 https://echa.europa.eu/registration-dossier/-/registered-dossier/28081
Cyclopentanecarboxylic acid, 2-hexyl-3-oxo-, methyl ester: Does not have an individual approval but may be used under an appropriate group standard
Chemie und Industrie
Verwendung und Herstellung
Household ProductsInformation on 105 consumer products that contain Methyldihydrojasmonate in the following categories is provided:；• Commercial / Institutional；• Inside the Home；• Landscaping/Yard；• Personal Care；• Pesticides
Use Classification
Fragrance Ingredients
Cosmetics -> Tonic
General Manufacturing InformationCyclopentanecarboxylic acid, 2-hexyl-3-oxo-, methyl ester: ACTIVE
Anbieter8 Anbieter
北京华美互利生物化工010-56205725 · [email protected]
北京大田丰拓化学技术有限公司13651141086 · [email protected]
宝鸡缔都医药化工有限公司029-81145305 17791533577 · [email protected]
上海问彩新材料科技有限公司15721586846 · [email protected]
XIAMEN AMITY INDUSTRY AND TRADE CO., LTD.+8618950047208 · [email protected]
广州市禄涞医药科技有限公司13660253774 · [email protected]
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
Hefei TNJ Chemical Industry Co.,Ltd.+86-0551-65418671 +86-189 4982 3763 · [email protected]
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