Tricyclo[6.2.1.02,7]undeca-4-ene - ≥96%(GC) , CAS No.91465-71-3

CAS: 91465-71-3 Cat. No.: T162359 Peso molecular: 148.25 PubChem CID: 548751

GRADE & PURITY ≥96%(GC)

Synonyms

Tricyclo[6.2.1.0(2,7)]undeca-4-ene | InChI=1/C11H16/c1-2-4-11-9-6-5-8(7-9)10(11)3-1/h1-2,8-11H,3-7H2 | AKOS015840952 | Tricyclo[6.2.1.02,7]undeca-4-ene | T1384 | tricyclo[6.2.1.02,7]undec-4-ene | 1,2,3,4,4a,5,8,8a-octahydro-1,4-methanonaphthalene | FT-069

Storage

Room temperature

Shipped In

Normal

Specifications

Sinónimos

Tricyclo[6.2.1.0(2, 7)]undeca-4-ene | InChI=1/C11H16/c1-2-4-11-9-6-5-8(7-9)10(11)3-1/h1-2, 8-11H, 3-7H2 | AKOS015840952 | Tricyclo[6.2.1.02, 7]undeca-4-ene | T1384 | tricyclo[6.2.1.02, 7]undec-4-ene | 1, 2, 3, 4, 4a, 5, 8, 8a-octahydro-1, 4-methanonaphthalene | FT-069

Especificaciones y pureza

≥96%(GC)

Condiciones de almacenamiento de almacenamiento

Room temperature

Enviado en

Normal

Pureza

≥96%(GC)

Nombres e identificadores

• Sonrisas canónicas: C1CC2CC1C3C2CC=CC3
• IUPAC Name: tricyclo[6.2.1.02,7]undec-4-ene
• InChIKey: YPOHZFOZYNRWKX-UHFFFAOYSA-N
• INCHI: 1S/C11H16/c1-2-4-11-9-6-5-8(7-9)10(11)3-1/h1-2,8-11H,3-7H2
• Isómeros SMILES: C1CC2CC1C3C2CC=CC3
• PubChem CID: 548751
• Peso molecular: 148.25
• Reaxy-Rn: 2552814

Taxonomic Classification

Taxonomy Tree

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

• Kingdom: Organic compounds
• Superclass: Lipids and lipid-like molecules
• Clase: Prenol lipids
• Subclass: Monoterpenoids
• Intermediate Tree Nodes: Not available
• Direct Parent: Monoterpenoids
• Alternative Parents: Polycyclic hydrocarbons Cyclic olefins Unsaturated aliphatic hydrocarbons
• Molecular Framework: Aliphatic homopolycyclic compounds
• Substituents: Norbornane monoterpenoid - Monoterpenoid - Polycyclic hydrocarbon - Cyclic olefin - Unsaturated aliphatic hydrocarbon - Unsaturated hydrocarbon - Olefin - Hydrocarbon - Aliphatic homopolycyclic compound
• Descripción: This compound belongs to the class of organic compounds known as monoterpenoids. These are compounds containing a chain of two isoprene units.
• 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

• Índice de refracción: 1.5
• Punto de inflamación (°C): 71 °C
• Punto de ebullición (°C): 209°C(lit.)
• Peso molecular: 148.240 g/mol
• XLogP3: 3.600
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 0
• Rotatable Bond Count: 0
• Exact Mass: 148.125 Da
• Monoisotopic Mass: 148.125 Da
• Topological Polar Surface Area: 0.000 Ų
• Heavy Atom Count: 11
• Formal Charge: 0
• Complexity: 172.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• Undefined Atom Stereocenter Count: 4
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 0
• Covalently-Bonded Unit Count: 1

Referencias

1. Fangyuan Guo, Nan Yu, Yunlong Jiao, Weiyong Hong, Kang Zhou, Xugang Ji, Huixing Yuan, Haiying Wang, Aiqin Li, Guoping Wang, Gensheng Yang.  (2021)  Star polyester-based folate acid-targeting nanoparticles for doxorubicin and curcumin co-delivery to combat multidrug-resistant breast cancer.  DRUG DELIVERY,      [PMID:34463174] [10.1080/10717544.2021.1960926]

2. Song Fang, Weisong Yu, Chengliang Li, Yuedong Liu, Jun Qiu, Fanyu Kong.  (2019)  Adsorption behavior of three triazole fungicides on polystyrene microplastics.  SCIENCE OF THE TOTAL ENVIRONMENT,      [PMID:31466193] [10.1016/j.scitotenv.2019.07.176]

3. Dadong Liang, Yan Wang, Songyang Li, Yuqing Li, Miliang Zhang, Yang Li, Weishuai Tian, Junbo Liu, Shanshan Tang, Bo Li, Ruifa Jin.  (2016)  Study on Dicyandiamide-Imprinted Polymers with Computer-Aided Design.  INTERNATIONAL JOURNAL OF MOLECULAR SCIENCES,  17  (11): (1750).  [PMID:27792186] [10.3390/ijms17111750]

4. Qi Nie, Jingjing Deng, Bing Xie, Tianshu Zhou.  (2023)  Enhanced-sensitivity and rapid-response for the detection of kanamycin based on ethanol-assisted AIEE effect in silver-doped gold nanoclusters.  MICROCHEMICAL JOURNAL,      [PMID:] [10.1016/j.microc.2023.108831]

5. Yuchuan Liu, Zongxue Yu, Yixin Peng, Liangyan Shao, Xiuhui Li, Haojie Zeng.  (2020)  A novel photocatalytic self-cleaning TiO2 nanorods inserted graphene oxide-based nanofiltration membrane.  CHEMICAL PHYSICS LETTERS,      [PMID:] [10.1016/j.cplett.2020.137424]