1,12-Dodecanediol Dimethacrylate (stabilized with MEHQ) - ≥95% , CAS No.72829-09-5

CAS: 72829-09-5 Cat. No.: D404197 Peso molecular: 338.49 Número EC: 276-900-4

GRADE & PURITY ≥95%

Synonyms

DTXSID501015491 | 2-Propenoic acid, 2-methyl-, 1,1'-(1,12-dodecanediyl) ester | 1,12-Bis(methacryloyloxy)dodecane | 1,12-Dodecanediyl dimethacrylate | 1,12-Dodecanediol Dimethacrylate (stabilized with MEHQ) | 2-Propenoic acid, 2-methyl-, 1,12-dodecanediyl

Storage

Room temperature

Specifications

Sinónimos

DTXSID501015491 | 2-Propenoic acid, 2-methyl-, 1, 1'-(1, 12-dodecanediyl) ester | 1, 12-Bis(methacryloyloxy)dodecane | 1, 12-Dodecanediyl dimethacrylate | 1, 12-Dodecanediol Dimethacrylate (stabilized with MEHQ) | 2-Propenoic acid, 2-methyl-, 1, 12-dodecanediyl

Especificaciones y pureza

≥95%

Condiciones de almacenamiento de almacenamiento

Room temperature

Pureza

≥95%

Nombres e identificadores

• Sonrisas canónicas: CC(=C)C(=O)OCCCCCCCCCCCCOC(=O)C(=C)C
• IUPAC Name: 12-(2-methylprop-2-enoyloxy)dodecyl 2-methylprop-2-enoate
• InChIKey: HYQASEVIBPSPMK-UHFFFAOYSA-N
• INCHI: 1S/C20H34O4/c1-17(2)19(21)23-15-13-11-9-7-5-6-8-10-12-14-16-24-20(22)18(3)4/h1,3,5-16H2,2,4H3
• Isómeros SMILES: CC(=C)C(=O)OCCCCCCCCCCCCOC(=O)C(=C)C
• Peso molecular: 338.49
• Reaxy-Rn: 9435841
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=9435841&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Lipids and lipid-like molecules
    • Clase Fatty Acyls
      • Subclass Fatty alcohol esters

• Kingdom: Organic compounds
• Superclass: Lipids and lipid-like molecules
• Clase: Fatty Acyls
• Subclass: Fatty alcohol esters
• Intermediate Tree Nodes: Not available
• Direct Parent: Fatty alcohol esters
• Alternative Parents: Dicarboxylic acids and derivatives Enoate esters Organic oxides Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Fatty alcohol ester - Dicarboxylic acid or derivatives - Alpha,beta-unsaturated carboxylic ester - Enoate ester - Carboxylic acid ester - Carboxylic acid derivative - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Carbonyl group - Aliphatic acyclic compound
• Descripción: This compound belongs to the class of organic compounds known as fatty alcohol esters. These are ester derivatives of a fatty alcohol.
• 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

• Solubilidad: Soluble in Methanol
• Índice de refracción: 1.46
• Peso molecular: 338.500 g/mol
• XLogP3: 6.600
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 17
• Exact Mass: 338.246 Da
• Monoisotopic Mass: 338.246 Da
• Topological Polar Surface Area: 52.600 Ų
• Heavy Atom Count: 24
• Formal Charge: 0
• Complexity: 360.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• 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

Referencias

1. Yufan Wang, Yue Wang, Li Qin, Zhuo Zhang, Yang Yu.  (2026)  Ionic liquid microemulsion-mediated heterogels with bicontinuous conductive channels for an ionic flexible sensor.  RSC Advances,  16  (9): (7844-7853).  [PMID:41659319] [10.1039/D5RA09922F]