Melonal - ≥80% , CAS No.106-72-9

CAS: 106-72-9 Cat. No.: M102621 Formula: C₉H₁₆O Peso molecolare: 140.22 Numero EC: 203-427-2

GRADE & PURITY ≥80%

Synonyms

2,6-DIMETHYL-5-HEPTENAL [FHFI] | NSC78450 | NSC-78450 | Tox21_300941 | 5-Heptenal,6-dimethyl- | NSC 78450 | 2,6-Dimethyl-5-heptenal, technical grade, 80% | 2,6-Dimethyl-5-heptenal | Bergamal | J-001636 | EINECS 203-427-2 | SY003221 | 2,6-dimethyl hept-5-e

Storage

Argon charged,Room temperature

Shipped In

Normal

Specifications

Sinonimi

2,6-DIMETHYL-5-HEPTENAL [FHFI] | NSC78450 | NSC-78450 | Tox21_300941 | 5-Heptenal,6-dimethyl- | NSC 78450 | 2,6-Dimethyl-5-heptenal, technical grade, 80% | 2,6-Dimethyl-5-heptenal | Bergamal | J-001636 | EINECS 203-427-2 | SY003221 | 2,6-dimethyl hept-5-e

Specifiche e purezza

≥80%

Condizioni di conservazione di stoccaggio

Argon charged,Room temperature

Spedito in

Normal

Purezza

≥80%

Nomi e identificatori

• Pubchem Sid: 528773389
• Sorrisi canonici: CC(CCC=C(C)C)C=O
• IUPAC Name: 2,6-dimethylhept-5-enal
• InChIKey: YGFGZTXGYTUXBA-UHFFFAOYSA-N
• INCHI: 1S/C9H16O/c1-8(2)5-4-6-9(3)7-10/h5,7,9H,4,6H2,1-3H3
• Isomeri SMILES: CC(CCC=C(C)C)C=O
• WGK Germania: 2
• RTECS: MJ8797000
• Peso molecolare: 140.22
• Reaxy-Rn: 1745855
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1745855&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic oxygen compounds
    • Classe Organooxygen compounds
      • Subclass Carbonyl compounds
        • Level5 Aldehydes
          • Level6 Medium-chain aldehydes

• Kingdom: Organic compounds
• Superclass: Organic oxygen compounds
• Classe: Organooxygen compounds
• Subclass: Carbonyl compounds
• Intermediate Tree Nodes: Aldehydes
• Direct Parent: Medium-chain aldehydes
• Alternative Parents: Organic oxides Hydrocarbon derivatives
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Medium-chain aldehyde - Organic oxide - Hydrocarbon derivative - Aliphatic acyclic compound
• Descrizione: This compound belongs to the class of organic compounds known as medium-chain aldehydes. These are an aldehyde with a chain length containing between 6 and 12 carbon atoms.
• External Descriptors: Fatty aldehydes

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

Proprietà chimiche e fisiche

• Sensibilità: Air sensitive.
• Indice di rifrazione: l.441～1.447
• Punto di infiammabilità (°F): 141.8 °F
• Punto di infiammabilità (°C): 141℃
• Punto di ebollizione (°C): 116°C
• Peso molecolare: 140.220 g/mol
• XLogP3: 2.500
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 4
• Exact Mass: 140.12 Da
• Monoisotopic Mass: 140.12 Da
• Topological Polar Surface Area: 17.100 Ų
• Heavy Atom Count: 10
• Formal Charge: 0
• Complexity: 121.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• Undefined Atom Stereocenter Count: 1
• 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. Qincao Chen, Penghui Yu, Ziyi Li, Yuhang Wang, Yafang Liu, Yin Zhu, Haihui Fu.  (2023)  Re-Rolling Treatment in the Fermentation Process Improves the Aroma Quality of Black Tea.  Foods,  12  (19): (3702).  [PMID:37835355] [10.3390/foods12193702]

2. Jinjia Liu, Min Chen, Weihua Ma, Lifang Zheng, Bing Zhang, Huiting Zhao, Yusuo Jiang.  (2023)  Composition of Strawberry Flower Volatiles and Their Effects on Behavior of Strawberry Pollinators, Bombus terrestris and Apis mellifera.  Agronomy-Basel,  13  (2): (339).  [PMID:] [10.3390/agronomy13020339]

3. Li Yang, Lu Xuteng, Cheng Xufeng, Xia Keyu, Hu Junyan, Wang Peiyu, Pang Peiyuan, Gao Bomin, Sun Demeng, Zhang Zhuzhen, Li Dongdong, Deng Zengqin, Tian Changlin, Xie Chang, Yao Jing.  (2025)  Plant essential oil targets TRPV3 for skin renewal and structural mechanism of action.  Nature Communications,  16  (1): (1-16).  [PMID:40108208] [10.1038/s41467-025-58033-9]

4. Hongyu Chen, Ronggang Jiang, Huimin An, Hao Xu, Xingchang Ou, Kuofei Wang, Yuan Chen, Youcang Jiang, Shi Li, Jianan Huang, Zhonghua Liu.  (2026)  Characterization of key odor-active volatiles in jasmine green tea by sensomics and chemometrics.  Food Chemistry-X,      [PMID:41799623] [10.1016/j.fochx.2026.103695]