(R)-(+)-Limonene - ≥95% , CAS No.5989-27-5

CAS: 5989-27-5 Cat. No.: R463296 Formule: C₁₀H₁₆ Poids moléculaire: 136.23 Beilstein Registry Number: 2204754 Numéro CE: 227-813-5

GRADE & PURITY ≥95%

Synonyms

1-Methyl-4-(1-methylethenyl)cyclohexene, (R)- | NSC-757069 | Sulfate turpentine, distilled | (R)-p-Mentha-1,8-diene | (+)-(R)-Limonene | EINECS 266-034-5 | XMGQYMWWDOXHJM-JTQLQIEISA-N | (+)-4-Isopropenyl-1-methylcyclohexene | Cyclohexene, 1-methyl-4-(1-me

Storage

Protected from light,Room temperature,Argon charged

Shipped In

FedEx DG Service

Specifications

Synonymes

1-Methyl-4-(1-methylethenyl)cyclohexene, (R)- | NSC-757069 | Sulfate turpentine, distilled | (R)-p-Mentha-1,8-diene | (+)-(R)-Limonene | EINECS 266-034-5 | XMGQYMWWDOXHJM-JTQLQIEISA-N | (+)-4-Isopropenyl-1-methylcyclohexene | Cyclohexene, 1-methyl-4-(1-me

Spécifications et pureté

≥95%

Conditions de stockage de stockage

Protected from light,Room temperature,Argon charged

Expédié en

FedEx DG Service

Pureté

≥95%

Noms et identifiants

Pubchem Sid

504758741

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/504758741

Sourires canoniques

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

IUPAC Name

(4R)-1-methyl-4-prop-1-en-2-ylcyclohexene

InChIKey

XMGQYMWWDOXHJM-JTQLQIEISA-N

INCHI

1S/C10H16/c1-8(2)10-6-4-9(3)5-7-10/h4,10H,1,5-7H2,2-3H3/t10-/m0/s1

Isomères SMILES

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

WGK Allemagne

2

RTECS

GW6360000

Numéro ONU

2319

Groupe d'emballage

III

Poids moléculaire

136.23

Beilstein

2204754

Reaxy-Rn

774123

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=774123&ln=

Taxonomic Classification

Taxonomy Tree

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

• Kingdom: Organic compounds
• Superclass: Lipids and lipid-like molecules
• Classe: Prenol lipids
• Subclass: Monoterpenoids
• Intermediate Tree Nodes: Not available
• Direct Parent: Menthane monoterpenoids
• Alternative Parents: Monocyclic monoterpenoids Branched unsaturated hydrocarbons Cycloalkenes Unsaturated aliphatic hydrocarbons
• Molecular Framework: Aliphatic homomonocyclic compounds
• Substituents: P-menthane monoterpenoid - Monocyclic monoterpenoid - Branched unsaturated hydrocarbon - Cycloalkene - Cyclic olefin - Unsaturated aliphatic hydrocarbon - Unsaturated hydrocarbon - Olefin - Hydrocarbon - Aliphatic homomonocyclic compound
• Description: 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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Mécanismes d'action

Propriétés chimiques et physiques

• Sensibilité: Light sensitive；Air sensitive
• Indice de réfraction: 1.47-1.474
• Rotation spécifique [α]: 120 ° (neat)
• Point d'éclair (°F): 118°F
• Point d'éclair (°C): 48℃
• Point d'ébullition (°C): 175.4-176°C
• Point de fusion (°C): -74°C
• Poids moléculaire: 136.230 g/mol
• XLogP3: 3.400
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 0
• Rotatable Bond Count: 1
• Exact Mass: 136.125 Da
• Monoisotopic Mass: 136.125 Da
• Topological Polar Surface Area: 0.000 Ų
• Heavy Atom Count: 10
• Formal Charge: 0
• Complexity: 163.000
• 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