1,3-Bis[2-(7-oxabicyclo[4.1.0]heptan-3-yl)ethyl]-1,1,3,3-tetramethyldisiloxane - ≥95% , CAS No.18724-32-8

CAS: 18724-32-8 Cat. No.: B405378 Molecular Weight: 382.69 EC Number: 643-053-0

GRADE & PURITY ≥95%

Synonyms

Bis-[2-(3,4-epocycyclohexyl)ethyl]tetramethyldisiloxane | AKOS016013486 | SCHEMBL1079186 | DTXSID70885068 | 1,3-Bis[2-(7-oxabicyclo[4.1.0]heptan-3-yl)ethyl]-1,1,3,3-tetramethyldisiloxane, >/=95% | 1,3-Bis[2-(3,4-epoxycyclohexyl)ethyl]tetramethyldisiloxane

Storage

Store at -20°C,Argon charged

Shipped In

Ice chest + Ice pads

Specifications

Synonyms

Bis-[2-(3, 4-epocycyclohexyl)ethyl]tetramethyldisiloxane | AKOS016013486 | SCHEMBL1079186 | DTXSID70885068 | 1, 3-Bis[2-(7-oxabicyclo[4.1.0]heptan-3-yl)ethyl]-1, 1, 3, 3-tetramethyldisiloxane, >/=95% | 1, 3-Bis[2-(3, 4-epoxycyclohexyl)ethyl]tetramethyldisiloxane

Specifications & Purity

≥95%

Storage

Store at -20°C, Argon charged

Shipped In

Ice chest + Ice pads

This product requires cold chain shipping. Ground and other economy services are not available.

Purity

≥95%

Names and Identifiers

• Canonical Smiles: C[Si](C)(CCC1CCC2C(C1)O2)O[Si](C)(C)CCC3CCC4C(C3)O4
• IUPAC Name: [dimethyl-[2-(7-oxabicyclo[4.1.0]heptan-3-yl)ethyl]silyl]oxy-dimethyl-[2-(7-oxabicyclo[4.1.0]heptan-3-yl)ethyl]silane
• InChIKey: UQOXIKVRXYCUMT-UHFFFAOYSA-N
• INCHI: 1S/C20H38O3Si2/c1-24(2,11-9-15-5-7-17-19(13-15)21-17)23-25(3,4)12-10-16-6-8-18-20(14-16)22-18/h15-20H,5-14H2,1-4H3
• Isomeric SMILES: C[Si](C)(CCC1CCC2C(C1)O2)O[Si](C)(C)CCC3CCC4C(C3)O4
• Molecular Weight: 382.69
• Reaxy-Rn: 25471
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=25471&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organometallic compounds
    • Class Organometalloid compounds
      • Subclass Organosilicon compounds
        • Level5 Siloxanes
          • Level6 Disiloxanes

• Kingdom: Organic compounds
• Superclass: Organometallic compounds
• Class: Organometalloid compounds
• Subclass: Organosilicon compounds
• Intermediate Tree Nodes: Siloxanes
• Direct Parent: Disiloxanes
• Alternative Parents: Oxepanes Trialkylheterosilanes Oxacyclic compounds Organic metalloid salts Epoxides Dialkyl ethers Hydrocarbon derivatives
• Molecular Framework: Aliphatic heteropolycyclic compounds
• Substituents: Disiloxane - Oxepane - Trialkylheterosilane - Organoheterosilane - Oxacycle - Organic metalloid salt - Organoheterocyclic compound - Ether - Oxirane - Dialkyl ether - Organic oxygen compound - Hydrocarbon derivative - Organooxygen compound - Aliphatic heteropolycyclic compound
• Description: This compound belongs to the class of organic compounds known as disiloxanes. These are organosilicon compounds with the general formula H[Si](R)(R')O[Si](H)(R'')R''' (R= organyl, R'-R'''= H or organyl).
• 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

Chemical and Physical Properties

• Sensitivity: Moisture Sensitive
• Refractive Index: 1.48
• Flash Point(°C): 200 °C
• Boil Point(°C): 195 °C/0.6 mmHg
• Molecular Weight: 382.700 g/mol
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 8
• Exact Mass: 382.236 Da
• Monoisotopic Mass: 382.236 Da
• Topological Polar Surface Area: 34.300 Ų
• Heavy Atom Count: 25
• Formal Charge: 0
• Complexity: 440.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• Undefined Atom Stereocenter Count: 6
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 0
• Covalently-Bonded Unit Count: 1

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