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HCID 175661Erstellt: 2. November 2026

2-(2-(4-Methylcyclohex-3-en-1-yl)propyl)cyclopentan-1-one

peach cyclopentanone · NECTARYL · Nectaryl 7446003 · 2-(p-Menth-1-ene-10-yl)cyclopentanone · 2-(p-Menthen-1-ene-9-yl)cyclopentan-1-one · 2-[2-(4-methyl-3-cyclohexen-1-yl)propyl]-cyclopentanon · 2-[2-(4-methyl-3-cyclohexen-1-yl)propyl]-Cyclopentanone · Cyclopentanone, 2-2-(4-methyl-3-cyclohexen-1-yl)propyl-

https://huagongshe.com/de/chemical/175661

Molekülstruktur von 2-(2-(4-Methylcyclohex-3-en-1-yl)propyl)cyclopentan-1-one

Identifikatoren & physikalische Daten

CAS No.	95962-14-4
Summenformel	C15H24O
Durchschnittliche Molmasse	220,35 g/mol
Monoisotopische Masse	220,18271539 g/mol
SMILES	CC1=CCC(C(C)CC2CCCC2=O)CC1
InChIKey	KNHGOYVXAHUDHP-UHFFFAOYSA-N
PubChem CID	175661
ChEMBL	CHEMBL3728992
EC No.	404-240-0
DTXSID	DTXSID3052646

Chemische & physikalische Eigenschaften

XLogP	3,4
Polarare Oberfläche (TPSA)	17,1
H-Brücken-Donoren	0
H-Brücken-Akzeptoren	1
Frei drehbare Bindungen	3
Schwere Atome	16
Formalladung	0
Komplexität	290
Duftstoffe	Fragrance Ingredient (2-(p-Menth-1-ene-10-yl)cyclopentanone) -> IFRA transparency List
Physical Description	Liquid
Siedepunkt	318.2±11.0 °C(Predicted)
Dichte	0.953±0.06 g/cm3(Predicted)
Dampfdruck	0.01-2750Pa at 20-25℃
Geruch	at 100.00 %. fruity tropical lactonic peach apricot oily waxy custard coconut
Geruchsart	fruity
Löslichkeit	4.6mg/L at 20℃
Kosmetik-Inhaltsstoffe Funktionen	PERFUMING
LogP (Verteilungskoeffizient)	4.8 at 20℃
EPA chemische Informationen	Cyclopentanone, 2-[2-(4-methyl-3-cyclohexen-1-yl)propyl]- (95962-14-4)

Sicherheit & Vorschriften

GHS-Einstufung	This chemical does not meet GHS hazard criteria for < 0.1% (1 of 1588) of reports.WarningH400 (97.6%): Very toxic to aquatic life [Warning Hazardous to the aquatic environment, acute hazard]P273, P391, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 1588 reports by companies from 9 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Regulatorische Informationen	Chemical: Cyclopentanone, 2-[2-(4-methyl-3-cyclohexen-1-yl)propyl]-Cyclopentanone, 2-[2-(4-methyl-3-cyclohexen-1-yl)propyl]- is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of Cyclopentanone, 2-[2-(4-methyl-3-cyclohexen-1-yl)propyl]- 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: 2-(2-(4-methyl-3-cyclohexen-1-yl)propyl)cyclopentanone (EC: 404-240-0)Cyclopentanone, 2-2-(4-methyl-3-cyclohexen-1-yl)propyl-: Does not have an individual approval but may be used under an appropriate group standard
Weitere Sicherheitsinformationen	Evaluation - Chemicals that are unlikely to require further regulation to manage risks to human health
Hazard Classes and Categories	Aquatic Acute 1 (98.4%)Aquatic Acute 1 (97.6%)
TSCA-Inventar-Status	TSCA listed

2-(2-(4-Methylcyclohex-3-en-1-yl)propyl)cyclopentan-1-one

CAS No.

95962-14-4

Summenformel

C15H24O

Durchschnittliche Molmasse

220,35 g/mol

Monoisotopische Masse

220,18271539 g/mol

SMILES

CC1=CCC(C(C)CC2CCCC2=O)CC1

InChIKey

KNHGOYVXAHUDHP-UHFFFAOYSA-N

PubChem CID

175661

ChEMBL

CHEMBL3728992

EC No.

404-240-0

DTXSID

DTXSID3052646

Chemische & physikalische Eigenschaften

XLogP

3,4

Polarare Oberfläche (TPSA)

17,1

H-Brücken-Donoren

H-Brücken-Akzeptoren

Frei drehbare Bindungen

Schwere Atome

Formalladung

Komplexität

290

Duftstoffe

Fragrance Ingredient (2-(p-Menth-1-ene-10-yl)cyclopentanone) -> IFRA transparency List

Physical Description

Liquid

Siedepunkt

318.2±11.0 °C(Predicted)

Dichte

0.953±0.06 g/cm3(Predicted)

Dampfdruck

0.01-2750Pa at 20-25℃

Geruch

at 100.00 %. fruity tropical lactonic peach apricot oily waxy custard coconut

Geruchsart

fruity

Löslichkeit

4.6mg/L at 20℃

Kosmetik-Inhaltsstoffe Funktionen

PERFUMING

LogP (Verteilungskoeffizient)

4.8 at 20℃

EPA chemische Informationen

Cyclopentanone, 2-[2-(4-methyl-3-cyclohexen-1-yl)propyl]- (95962-14-4)

Sicherheit & Vorschriften

GHS-Einstufung

This chemical does not meet GHS hazard criteria for < 0.1% (1 of 1588) of reports.WarningH400 (97.6%): Very toxic to aquatic life [Warning Hazardous to the aquatic environment, acute hazard]P273, P391, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 1588 reports by companies from 9 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Regulatorische Informationen

Chemical: Cyclopentanone, 2-[2-(4-methyl-3-cyclohexen-1-yl)propyl]-Cyclopentanone, 2-[2-(4-methyl-3-cyclohexen-1-yl)propyl]- is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of Cyclopentanone, 2-[2-(4-methyl-3-cyclohexen-1-yl)propyl]- 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: 2-(2-(4-methyl-3-cyclohexen-1-yl)propyl)cyclopentanone (EC: 404-240-0)Cyclopentanone, 2-2-(4-methyl-3-cyclohexen-1-yl)propyl-: Does not have an individual approval but may be used under an appropriate group standard

Weitere Sicherheitsinformationen

Evaluation - Chemicals that are unlikely to require further regulation to manage risks to human health

Hazard Classes and Categories

Aquatic Acute 1 (98.4%)Aquatic Acute 1 (97.6%)

TSCA-Inventar-Status

TSCA listed