α-Caryophyllene - ≥93% , CAS No.6753-98-6

CAS: 6753-98-6 Cat. No.: A151142 Formula: C₁₅H₂₄ Peso molecolare: 204.36 Numero EC: 229-816-7

GRADE & PURITY ≥93%

Synonyms

alpha -humulenen | Humulene; -Caryophyllene | 2,6,6,9-Tetramethyl-1,4,8-cycloundecatriene (E,E,E)- | alpha-Humulene, >=96.0% (GC) | Alpha caryophyllene | Alpha-caryophylla-2,8(14)-diene | Cycloundeca-1,4,8-triene,2,6,6,9-tetramethyl- | 2,6,6,9-Tetramethyl

Storage

Store at -20°C,Argon charged

Shipped In

Ice chest + Ice pads

Panoramica

α-Humulene is a cyclic sesquiterpene, a main active constituent isolated from plant Cordia verbenacea (Boraginaceae).

Specifications

Sinonimi

alpha -humulenen | Humulene; -Caryophyllene | 2,6,6,9-Tetramethyl-1,4,8-cycloundecatriene (E,E,E)- | alpha-Humulene, >=96.0% (GC) | Alpha caryophyllene | Alpha-caryophylla-2,8(14)-diene | Cycloundeca-1,4,8-triene,2,6,6,9-tetramethyl- | 2,6,6,9-Tetramethyl

Specifiche e purezza

≥93%

Condizioni di conservazione di stoccaggio

Store at -20°C,Argon charged

Spedito in

Ice chest + Ice pads

Questo prodotto richiede spedizione a catena fredda. I servizi di terra e altri servizi economici non sono disponibili.

Tipo di azione

INHIBITOR

Purezza

≥93%

Nomi e identificatori

• Pubchem Sid: 504763358
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/504763358
• Sorrisi canonici: CC1=CCC(C=CCC(=CCC1)C)(C)C
• IUPAC Name: (1E,4E,8E)-2,6,6,9-tetramethylcycloundeca-1,4,8-triene
• InChIKey: FAMPSKZZVDUYOS-HRGUGZIWSA-N
• INCHI: 1S/C15H24/c1-13-7-5-8-14(2)10-12-15(3,4)11-6-9-13/h6-7,10-11H,5,8-9,12H2,1-4H3/b11-6+,13-7+,14-10+
• Isomeri SMILES: C/C/1=C\CC(/C=C/C/C(=C/CC1)/C)(C)C
• WGK Germania: 3
• RTECS: GZ4817500
• Peso molecolare: 204.36
• Reaxy-Rn: 11327564
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=11327564&ln=

Taxonomic Classification

Taxonomy Tree

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

• Kingdom: Organic compounds
• Superclass: Lipids and lipid-like molecules
• Classe: Prenol lipids
• Subclass: Sesquiterpenoids
• Intermediate Tree Nodes: Not available
• Direct Parent: Sesquiterpenoids
• Alternative Parents: Branched unsaturated hydrocarbons Cyclic olefins Unsaturated aliphatic hydrocarbons
• Molecular Framework: Aliphatic homomonocyclic compounds
• Substituents: Humulane sesquiterpenoid - Sesquiterpenoid - Branched unsaturated hydrocarbon - Cyclic olefin - Unsaturated aliphatic hydrocarbon - Unsaturated hydrocarbon - Olefin - Hydrocarbon - Aliphatic homomonocyclic compound
• Descrizione: This compound belongs to the class of organic compounds known as sesquiterpenoids. These are terpenes with three consecutive isoprene units.
• External Descriptors: Humulane sesquiterpenoids

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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Meccanismi d'azione

Proprietà chimiche e fisiche

• Sensibilità: air sensitive
• Indice di rifrazione: 1.5020 to 1.5040
• Punto di infiammabilità (°F): 194 °F
• Punto di infiammabilità (°C): 90°C
• Punto di ebollizione (°C): 123°C/10mmHg
• Peso molecolare: 204.350 g/mol
• XLogP3: 4.500
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 0
• Rotatable Bond Count: 0
• Exact Mass: 204.188 Da
• Monoisotopic Mass: 204.188 Da
• Topological Polar Surface Area: 0.000 Ų
• Heavy Atom Count: 15
• Formal Charge: 0
• Complexity: 287.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• Undefined Atom Stereocenter Count: 0
• Defined Bond Stereocenter Count: 3
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 3
• Covalently-Bonded Unit Count: 1

Riferimenti

1. Jilai Cui, Xiaoting Zhai, Danyang Guo, Wenkai Du, Ting Gao, Jie Zhou, Wilfried G. Schwab, Chuankui Song.  (2021)  Characterization of Key Odorants in Xinyang Maojian Green Tea and Their Changes During the Manufacturing Process.  JOURNAL OF AGRICULTURAL AND FOOD CHEMISTRY,      [PMID:34932338] [10.1021/acs.jafc.1c06473]

2. Kai Hong, Zhenzhen Xu, Limin Wang, Agbaka Johnpaul, Yongqiang Cheng, Chenyan Lv, Changwei Ma.  (2021)  Varietal differences in the phytochemical components’ accumulation and aroma profile of three Humulus lupulus cultivars.  FOOD CONTROL,      [PMID:] [10.1016/j.foodcont.2021.108499]

3. Yuchen Bai, Ningke You, Hongyu Tian, Xuebing Zhao.  (2025)  Characterization of Key Odorants in Hemp Seed Oil Extracted from the Hemp Seeds Roasted Under Various Conditions.  Processes,  13  (2): (530).  [PMID:] [10.3390/pr13020530]

4. Xiaolu Zhou, Ling Xia, Yufei Hu, Gongke Li.  (2026)  Cyclic cataluminescence terpene array sensor based on γ-Al2O3/Eu-BTC for rapid hop origin identification.  FOOD CHEMISTRY,      [PMID:] [10.1016/j.foodchem.2026.150454]