trans-trans-2,4-Hexadiene - ≥90% , CAS No.5194-51-4

CAS: 5194-51-4 Cat. No.: B300314 Peso molecular: 82.15

GRADE & PURITY ≥90%

Synonyms

2,4-HEXADIENE|(2E,4E)-hexa-2,4-diene|592-46-1|5194-51-4|trans,trans-2,4-Hexadiene|Dipropenyl|2,4-Hexadiene, (E,E)-|2,4-hexadiene, (2E,4E)-|Bipropenyl|trans,trans-Hexa-2,4-diene|(2E,4E)-2,4-Hexadiene|1,4-Dimethylbutadiene|8NFN12O8UQ|(E),(E)-CH3CH=CHCH=CHCH

Storage

Argon charged,Room temperature

Shipped In

Normal

Specifications

Sinónimos

2, 4-HEXADIENE | (2E, 4E)-hexa-2, 4-diene | 592-46-1 | 5194-51-4 | trans, trans-2, 4-Hexadiene | Dipropenyl | 2, 4-Hexadiene, (E, E)- | 2, 4-hexadiene, (2E, 4E)- | Bipropenyl | trans, trans-Hexa-2, 4-diene | (2E, 4E)-2, 4-Hexadiene | 1, 4-Dimethylbutadiene | 8NFN12O8UQ | (E), (E)-CH3CH=CHCH=CHCH

Especificaciones y pureza

≥90%

Condiciones de almacenamiento de almacenamiento

Argon charged, Room temperature

Enviado en

Normal

Pureza

≥90%

Nombres e identificadores

• Sonrisas canónicas: CC=CC=CC
• IUPAC Name: (2E,4E)-hexa-2,4-diene
• InChIKey: APPOKADJQUIAHP-GGWOSOGESA-N
• INCHI: 1S/C6H10/c1-3-5-6-4-2/h3-6H,1-2H3/b5-3+,6-4+
• Isómeros SMILES: C/C=C/C=C/C
• CAS alternativo: 592-46-1
• Peso molecular: 82.15
• Reaxy-Rn: 605270
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=605270&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Hydrocarbons
    • Clase Unsaturated hydrocarbons
      • Subclass Olefins
        • Level5 Acyclic olefins
          • Level6 Alkadienes

• Kingdom: Organic compounds
• Superclass: Hydrocarbons
• Clase: Unsaturated hydrocarbons
• Subclass: Olefins
• Intermediate Tree Nodes: Acyclic olefins
• Direct Parent: Alkadienes
• Alternative Parents: Unsaturated aliphatic hydrocarbons
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Alkadiene - Unsaturated aliphatic hydrocarbon - Aliphatic acyclic compound
• Descripción: This compound belongs to the class of organic compounds known as alkadienes. These are acyclic hydrocarbons that contain exactly two carbon-to-carbon double bonds.
• External Descriptors: Not available

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

Propiedades químicas y físicas

• Peso molecular: 82.140 g/mol
• XLogP3: 2.800
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 0
• Rotatable Bond Count: 1
• Exact Mass: 82.0783 Da
• Monoisotopic Mass: 82.0783 Da
• Topological Polar Surface Area: 0.000 Ų
• Heavy Atom Count: 6
• Formal Charge: 0
• Complexity: 48.400
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• Undefined Atom Stereocenter Count: 0
• Defined Bond Stereocenter Count: 2
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 2
• Covalently-Bonded Unit Count: 1

Referencias

1. Fukang Zheng, Yanhui Cheng, Huiyu Dong, Lei Sun, Fei Pan, Xiangjuan Yuan.  (2023)  Insights into the novel oxidation process of ozone/peracetic acid: Kinetics evaluation, degradation pathways, and toxicity assessment.  CHEMICAL ENGINEERING JOURNAL,      [PMID:] [10.1016/j.cej.2023.145964]

2. Bin Liu, Yin Jun, Changrong Zhao, Chu Zhou, Tingting Zhu, Senlin Shao.  (2023)  Using Fe(II)/Fe(VI) activated peracetic acid as pretreatment of ultrafiltration for secondary effluent treatment: Water quality improvement and membrane fouling mitigation.  WATER RESEARCH,      [PMID:37659184] [10.1016/j.watres.2023.120533]

3. Zhao Song, Yu Zhang, Xue Zhang, Xu Zhou, Yidi Chen, Xiaoguang Duan, Nanqi Ren.  (2023)  Kinetics study of chloride-activated peracetic acid for purifying bisphenol A: Role of Cl2/HClO and carbon-centered radicals.  WATER RESEARCH,      [PMID:37406560] [10.1016/j.watres.2023.120274]

4. Shao Shujing, Zhang Pengyu, Chen Yang, Zhao Xiaodan.  (2023)  Enhanced tetracycline abatement by peracetic acid activation with sulfidation of nanoscale zerovalent iron.  ENVIRONMENTAL SCIENCE AND POLLUTION RESEARCH,  30  (30): (76157-76170).  [PMID:37231132] [10.1007/s11356-023-27779-4]

5. Chengzhi Yu, Libin Zheng, Yongyuan Hong, Jiabin Chen, Feng Gao, Yalei Zhang, Xuefei Zhou, Libin Yang.  (2022)  Activation of Peracetic Acid with CuFe2O4 for Rhodamine B Degradation: Activation by Cu and the Contribution of Acetylperoxyl Radicals.  MOLECULES,  27  (19): (6385).  [PMID:36234920] [10.3390/molecules27196385]

6. Yajie Qian, Jinjing Huang, Jiabin Chen, Gang Xue, Zilin Zhou, Pin Gao.  (2021)  Activation of peracetic acid by RuO2/MWCNTs to degrade sulfamethoxazole at neutral condition.  CHEMICAL ENGINEERING JOURNAL,      [PMID:] [10.1016/j.cej.2021.134217]

7. Pengyu Zhang, Xianfa Zhang, Xiaodan Zhao, Guohua Jing, Zuoming Zhou.  (2021)  Activation of peracetic acid with zero-valent iron for tetracycline abatement: The role of Fe(II) complexation with tetracycline.  JOURNAL OF HAZARDOUS MATERIALS,      [PMID:34801301] [10.1016/j.jhazmat.2021.127653]

8. Sichu Xing, Chundi Zhou, Minghao Sui.  (2025)  Activated carbon-supported nano zero-valent iron (nZVI@AC) for enhanced peracetic acid activation in Fenton-like degradation of sulfamethoxazole.  MATERIALS RESEARCH BULLETIN,      [PMID:] [10.1016/j.materresbull.2025.113780]

9. Jingzhen Su, Yong Wang, Cong Li, Zhengming He, Kai Zhang, Mingqiang Ren, Qile Wang, Tianxing Chen, Jibran Ali Ghumro, Virender K. Sharma, Hyunook Kim, Yunshu Zhang.  (2025)  Nonradical degradation of antibiotics in seawater by Cl−/Br−-activated peracetic acid: Dominant contribution of 1O2 and reactive halogens.  Journal of Environmental Chemical Engineering,      [PMID:] [10.1016/j.jece.2025.119405]