p-Menthan-3-on

p-Menthan-3-one

HCID 6986CAS 10458-14-7
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Grundinformationen

Standard-SMILES
CC1CCC(C(C)C)C(=O)C1
InChIKey
NFLGAXVYCFJBMK-UHFFFAOYSA-N
Summenformel
C10H18O
Durchschnittliche Molmasse
154,25 g/mol
Monoisotopische Masse
154,1357652

Überblick

P-menthan-3-one is a p-menthane monoterpenoid that is p-menthane substituted by an oxo group at position 3. It has a role as a volatile oil component and a plant metabolite.

Namen und Bezeichner

Bevorzugter Name
p-Menthan-3-one
IUPAC
5-methyl-2-propan-2-ylcyclohexan-1-one
Lokaler Name
p-Menthan-3-on
Englischer Name
Menthone
Summenformel
C10H18O
Molmasse
154.25

Namen und Synonyme

10458-14-7p-Menthan-3-one2-Isopropyl-5-methylcyclohexanone5-Methyl-2-(1-methylethyl)cyclohexanone5-Methyl-2-(isopropylcyclo)hexanoneNSC 1131345-Methyl-2-(isopropyl)cyclohexanoneEINECS 233-944-9CHEBI:36742DTXSID808591545-methyl-2-(propan-2-yl)cyclohexanoneRefChem:858108
Weitere Namen anzeigen
DL-MENTHONEMENTHONEp-menthan-MENTHONE 95MENTHONE(AS)(+/-)-MENTHONE
DTXCID00209894233-944-9Cyclohexanone, 5-methyl-2-(1-methylethyl)-5-methyl-2-propan-2-ylcyclohexan-1-one491-07-62-Isopropyl-5-methyl-cyclohexanone5-methyl-2-(propan-2-yl)cyclohexan-1-onep-Menthanone

Datenbank-Bezeichner

CAS
10458-14-7、18309-28-9、491-07-6
PubChem CID
6986
DTXSID
DTXSID80859154
ChEMBL
CHEMBL1719455
ChEBI
CHEBI:36742
EC Number
207-727-4、233-944-9、242-194-1、905-013-3
Nikkaji
J633E

Eigenschaften

Berechnete Struktureigenschaften

XLogP
2,7
Polarare Oberfläche (TPSA)
17,1 Ų
H-Brücken-Donoren
0
H-Brücken-Akzeptoren
1
Frei drehbare Bindungen
1
Schwere Atome
11

Experimentelle und physikochemische Eigenschaften

DrugsPharmaceuticals
SpringerMaterials PropertiesBoiling point
Fragrances · 2 Einträge

Fragrance Ingredient (d,l-Isomenthone) -> IFRA transparency List

Fragrance Ingredient (Menthone) -> IFRA transparency List

Density0.895-0.925
Flavoring Agents · 2 Einträge

EU Flavoring substances

EU Flavoring substances

Solubility(in ethanol)

Physikochemische Eigenschaften

Schmelzpunkt
-6 °C · -6 °C
Siedepunkt
85 · 85-88 °C/12 mmHg (lit.)
Dichte
0.896 g/mL · 0.896 g/mL at 20 °C (lit.)
Brechungsindex
20 · n20/D 1.450
FEMA
2667 · 2667 | MENTHONE
Flammpunkt
69 °C · 69 °C

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 6 Einträge

This chemical does not meet GHS hazard criteria for 5.3% (87 of 1631) of reports.

Warning

H315 (88.8%): Causes skin irritation [Warning Skin corrosion/irritation]

P261, P264, P272, P280, P302+P352, P321, P332+P317, P333+P317, P362+P364, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 1631 reports by companies from 10 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Warning

Gefahrenhinweise

Regulatory Information · 6 Einträge

Chemical: Cyclohexanone, 5-methyl-2-(1-methylethyl)-, cis-

Regulation (EC) No 1831/2003 (amended)

Commission Regulation (EC) No 1565/2000 (Repealed by Com. Implementing Reg. (EU) No 872/2012)

Cyclohexanone, 5-methyl-2-(1-methylethyl)-, (2R,5R)-rel- is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of Cyclohexanone, 5-methyl-2-(1-methylethyl)-, (2R,5R)-rel- 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: 03-09-2018 https://echa.europa.eu/registration-dossier/-/registered-dossier/10792

2-Isopropyl-5-methylcyclohexanone: Does not have an individual approval but may be used as a component in a product covered by a group standard. It is not approved for use as a chemical in its own right.

Other Safety InformationIMAP assessments - Menthone and isomenthone: Human health tier II assessment
Hazard Classes and Categories · 4 Einträge

Skin Irrit. 2 (88.8%)

Flam. Liq. 3 (86.3%)

Skin Irrit. 2 (50%)

Skin irritation - category 2

Sicherheitsdaten

wgk
3
ridadr
NA 1993 / PGIII
hs_code
29142990
RTECS-Nr.
OS9541500
risk_code
22-36-43-52/53
hazard_code
Xn

Chemie und Industrie

Verwendung und Herstellung

U.S. Production2023: 104 lb
Consumer UsesNot Known or Reasonably Ascertainable
Industry UsesNot Known or Reasonably Ascertainable
Household Products · 2 Einträge

Information on 11 consumer products that contain Isomenthone in the following categories is provided:

Information on 9 consumer products that contain P-Menthanone in the following categories is provided:

Use Classification · 3 Einträge

Fragrance Ingredients

Fragrance Ingredients

Flavoring Agents -> JECFA Flavorings Index

General Manufacturing Information · 2 Einträge

Not Known or Reasonably Ascertainable

Cyclohexanone, 5-methyl-2-(1-methylethyl)-, (2R,5R)-rel-: ACTIVE

Anwendungen · 1 Eintrag

VerwendenMenthone has been used in the following studies:To prepare the model flavor mix in a study to investigate the release of various aroma compounds in xanthan-thickened food model systems having different viscosities. As standard in the quantification of volatile constituents and odour-activity value (OAV) in ′Marion′ and ′Black Diamond′. Modified semisolid agar antifungal susceptibility method (SAAS) to investigate the anti-fungal activities of various cyclic terpenes against Fusarium verticillioides MRC 826.

Vor- und nachgelagerte Produkte

Nachgelagerte Produkte

Anbieter50 Anbieter

成都彼样生物科技有限公司18108052721 · [email protected]
合肥翰刚医药科技有限公司+8618062405514 · [email protected]
Hebei Yanxi Chemical Co., Ltd.+86-17531190177 · [email protected]
Syntechem Co.,Ltd[email protected]
上海迈瑞尔生化科技有限公司4006356688 18621169109 · [email protected]

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