L(-)-Carvone - ≥99% , CAS No.6485-40-1

CAS: 6485-40-1 Cat. No.: C117707 Summenformel: C₁₀H₁₄O Molekulargewicht: 150.22 Beilstein Registry Number: 2206714 EG-Nummer: 229-352-5

QUALITÄT & REINHEIT ≥99%

Synonyms

(R)-CARVONE (CONSTITUENT OF MYRRH) | 2-Cyclohexen-1-one, 2-methyl-5-(1-methylethenyl)-, (R)- | AKOS006343214 | Q-103514 | DTXCID5021413 | DTXSID7041413 | EN300-298834 | L-Carvone, >=97%, FCC, FG | (5R)-2-methyl-5-(prop-1-en-2-yl)cyclohex-2-en-1-one | 07V

Storage

Room temperature,Argon charged

Shipped In

Normal

Übersicht

(R)-(-)-Carvone is a monoterpenoid. Its ozonolysis in the gaseous phase has been proposed. Aldehydes (formaldehyde) and biradicals were obtained as the major products. It participates in the diastereoselective synthesis of homochiral octalones.

(R)-(-)-Carvone may be employed as starting reagent for the synthesis of enantiopure (R)-(+)-3-methyl-6-isopropenyl-cyclohept-3-enone-1, a useful intermediate formed during the synthesis of terpenoids. It may be employed as starting reagent for the synthesis of differently protected (4S,6R,7R)-trihydroxy-1-octyne derivatives.

Spezifikationen

Synonyme

(R)-CARVONE (CONSTITUENT OF MYRRH) | 2-Cyclohexen-1-one, 2-methyl-5-(1-methylethenyl)-, (R)- | AKOS006343214 | Q-103514 | DTXCID5021413 | DTXSID7041413 | EN300-298834 | L-Carvone, >=97%, FCC, FG | (5R)-2-methyl-5-(prop-1-en-2-yl)cyclohex-2-en-1-one | 07V

Spezifikationen & Reinheit

≥99%

Storage

Room temperature,Argon charged

Verschickt in

Normal

Aktionsart

INHIBITOR

Reinheit

≥99%

Namen und Kennungen

Pubchem Sid

488189748

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/488189748

Kanonisches Lächeln

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

IUPAC Name

(5R)-2-methyl-5-prop-1-en-2-ylcyclohex-2-en-1-one

InChIKey

ULDHMXUKGWMISQ-SECBINFHSA-N

INCHI

1S/C10H14O/c1-7(2)9-5-4-8(3)10(11)6-9/h4,9H,1,5-6H2,2-3H3/t9-/m1/s1

Isomere SMILES

CC1=CC[C@H](CC1=O)C(=C)C

WGK Deutschland

2

RTECS

OS8650000

Molekulargewicht

150.22

Beilstein

2206714

Reaxy-Rn

1364206

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1364206&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Lipids and lipid-like molecules
    • Klasse Prenol lipids
      • Subclass Monoterpenoids

• Kingdom: Organic compounds
• Superclass: Lipids and lipid-like molecules
• Klasse: Prenol lipids
• Subclass: Monoterpenoids
• Intermediate Tree Nodes: Not available
• Direct Parent: Menthane monoterpenoids
• Alternative Parents: Monocyclic monoterpenoids Cyclohexenones Organic oxides Hydrocarbon derivatives
• Molecular Framework: Aliphatic homomonocyclic compounds
• Substituents: P-menthane monoterpenoid - Monocyclic monoterpenoid - Cyclohexenone - Cyclic ketone - Ketone - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Carbonyl group - Aliphatic homomonocyclic compound
• Beschreibung: This compound belongs to the class of organic compounds known as menthane monoterpenoids. These are monoterpenoids with a structure based on the o-, m-, or p-menthane backbone. P-menthane consists of the cyclohexane ring with a methyl group and a (2-methyl)-propyl group at the 1 and 4 ring position, respectively. The o- and m- menthanes are much rarer, and presumably arise by alkyl migration of p-menthanes.
• External Descriptors: Menthane monoterpenoids

Data sources

1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61.

DOI: 10.1186/s13321-016-0174-y

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Wirkungsmechanismen

Chemische und physikalische Eigenschaften

• Löslichkeit: Miscible with alcohol, ether, chloroform, propylene glycol and mineral oils. Immiscible with water and glycerol.
• Empfindlichkeit: Light and air sensitive
• Brechungsindex: 1.495-1.502
• Spezifische Drehung [α]: -61.5 ° (neat)
• Flammpunkt (°F): 201.2 °F
• Flammpunkt (°C): 88°C
• Siedepunkt (°C): 227-230°C
• Molekulargewicht: 150.220 g/mol
• XLogP3: 2.400
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 1
• Exact Mass: 150.104 Da
• Monoisotopic Mass: 150.104 Da
• Topological Polar Surface Area: 17.100 Ų
• Heavy Atom Count: 11
• Formal Charge: 0
• Complexity: 223.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 1
• Undefined Atom Stereocenter Count: 0
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 0
• Covalently-Bonded Unit Count: 1