(-)-Verbenone - ≥95%(GC) , CAS No.1196-01-6

CAS: 1196-01-6 Cat. No.: V162981 Formula: C₁₀H₁₄O Peso molecolare: 150.22 Numero EC: 214-807-2 PubChem CID: 92874

GRADE & PURITY ≥95%(GC)

Synonyms

LEVOVERBENONE [WHO-DD] | trans-Lutein | DTXCID7015620 | (2E,4E,6E,8E,10E,12E,14E)-2,6,11,15-tetramethylhexadeca-2,4,6,8,10,12,14-heptaenedioic acid | D92784 | Verbenone, (-)- | (1S)-(-)-Verbenone, >=93% | Z1123686398 | (1S)-(-)-Verbenone | AS-70360 | NCGC

Storage

Argon charged,Room temperature

Shipped In

Normal

Specifications

Sinonimi

LEVOVERBENONE [WHO-DD] | trans-Lutein | DTXCID7015620 | (2E,4E,6E,8E,10E,12E,14E)-2,6,11,15-tetramethylhexadeca-2,4,6,8,10,12,14-heptaenedioic acid | D92784 | Verbenone, (-)- | (1S)-(-)-Verbenone, >=93% | Z1123686398 | (1S)-(-)-Verbenone | AS-70360 | NCGC

Specifiche e purezza

≥95%(GC)

Condizioni di conservazione di stoccaggio

Argon charged,Room temperature

Spedito in

Normal

Purezza

≥95%(GC)

Nomi e identificatori

• Pubchem Sid: 488186736
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/488186736
• Sorrisi canonici: CC1=CC(=O)C2CC1C2(C)C
• IUPAC Name: (1S,5S)-4,6,6-trimethylbicyclo[3.1.1]hept-3-en-2-one
• InChIKey: DCSCXTJOXBUFGB-JGVFFNPUSA-N
• INCHI: 1S/C10H14O/c1-6-4-9(11)8-5-7(6)10(8,2)3/h4,7-8H,5H2,1-3H3/t7-,8+/m0/s1
• Isomeri SMILES: CC1=CC(=O)[C@H]2C[C@@H]1C2(C)C
• WGK Germania: 3
• PubChem CID: 92874
• Peso molecolare: 150.22
• Reaxy-Rn: 1562790

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: Bicyclic monoterpenoids
• Alternative Parents: Cyclohexenones Organic oxides Hydrocarbon derivatives
• Molecular Framework: Aliphatic homopolycyclic compounds
• Substituents: Pinane monoterpenoid - Bicyclic monoterpenoid - Cyclohexenone - Ketone - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Carbonyl group - Aliphatic homopolycyclic compound
• Descrizione: This compound belongs to the class of organic compounds known as bicyclic monoterpenoids. These are monoterpenoids containing exactly 2 rings, which are fused to each other.
• External Descriptors: 4,6,6-trimethylbicyclo[3.1.1]hept-3-en-2-one

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

Meccanismi d'azione

Proprietà chimiche e fisiche

• Sensibilità: Air sensitive
• Indice di rifrazione: 1.5
• Rotazione specifica [α]: -150° to -250°(C=4, CHCl3)
• Punto di infiammabilità (°F): 185 °F
• Punto di infiammabilità (°C): 109°C
• Punto di ebollizione (°C): 227-228 °C
• Peso molecolare: 150.220 g/mol
• XLogP3: 1.600
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 0
• 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: 248.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 2
• 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

Riferimenti

1. Hongyun Wang, Haijun Cheng, Fang Lai, Deyuan Xiong.  (2022)  CuAPO-5 as a Multiphase Catalyst for Synthesis of Verbenone from α-Pinene.  Materials,  15  (22): (8097).  [PMID:36431582] [10.3390/ma15228097]

2. Qianhao Pan, Jiaxing Fang, Shiming Zhang, Yonglin He, Yapei Wang.  (2022)  Biorhythm paralleled release of pheromone by photothermal conversion for Long-term bark beetle control.  CHEMICAL ENGINEERING JOURNAL,      [PMID:] [10.1016/j.cej.2022.135933]

3. Zheng Chengyu, Zhou Qinan, Wang Zhenhe, Wang Jun.  (2021)  Behavioral responses of Platycladus orientalis plant volatiles to Phloeosinus aubei by GC-MS and HS-GC-IMS for discrimination of different invasive severity.  ANALYTICAL AND BIOANALYTICAL CHEMISTRY,  413  (23): (5789-5798).  [PMID:34322736] [10.1007/s00216-021-03556-5]

4. Xiaoming Zeng, Hao He, Liejiang Yuan, Haizhi Wu, Cong Zhou.  (2024)  Determination of 24 Trace Aromatic Substances in Rosemary Hydrosol by Dispersed Liquid–Liquid Microextraction–Gas Chromatography.  Processes,  12  (3): (498).  [PMID:] [10.3390/pr12030498]

5. Pengfei Yang, Lingqi Kong, Qiongbo Wang, Qiang Liu, Xiujin Duan, Chen Hu, Zhengbo Feng, Qi Yang, Huabo Jv.  (2026)  Analysis of volatile compounds in Aglaia odorata flower extracts with different possessing methods by HS-SPME-GC-MS and E-nose.  Frontiers in Chemistry,      [PMID:41867951] [10.3389/fchem.2026.1746408]