Chlorodiisobutyloctadecylsilane - ≥85% , CAS No.162578-86-1

CAS: 162578-86-1 Cat. No.: C348435 Molecular Weight: 431.27 EC Number: 620-811-9

GRADE & PURITY ≥85%

Synonyms

GS-6394 | Chlorodiisobutyloctadecylsilane | DTXSID30408131 | Silane,chlorobis(2-methylpropyl)octadecyl- | chloro-bis(2-methylpropyl)-octadecylsilane | chlorobis(2-methylpropyl)octadecylsilane | n-octadecyldiisobutylchlorosilane | J-009953 | MFCD00191911 |

Storage

Protected from light,Room temperature,Argon charged

Shipped In

Normal

Overview

Remainder octadecane

Specifications

Synonyms

GS-6394 | Chlorodiisobutyloctadecylsilane | DTXSID30408131 | Silane, chlorobis(2-methylpropyl)octadecyl- | chloro-bis(2-methylpropyl)-octadecylsilane | chlorobis(2-methylpropyl)octadecylsilane | n-octadecyldiisobutylchlorosilane | J-009953 | MFCD00191911 |

Specifications & Purity

≥85%

Storage

Protected from light, Room temperature, Argon charged

Shipped In

Normal

Purity

≥85%

Names and Identifiers

• Canonical Smiles: CCCCCCCCCCCCCCCCCC[Si](CC(C)C)(CC(C)C)Cl
• IUPAC Name: chloro-bis(2-methylpropyl)-octadecylsilane
• InChIKey: LAMXXRLSKVGVCO-UHFFFAOYSA-N
• INCHI: 1S/C26H55ClSi/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-28(27,23-25(2)3)24-26(4)5/h25-26H,6-24H2,1-5H3
• Isomeric SMILES: CCCCCCCCCCCCCCCCCC[Si](CC(C)C)(CC(C)C)Cl
• Molecular Weight: 431.27
• Reaxy-Rn: 9442699
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=9442699&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organometallic compounds
    • Class Organometalloid compounds
      • Subclass Organosilicon compounds
        • Level5 Organoheterosilanes
          • Level6 Trialkylheterosilanes
            • Level7 Trialkylchlorosilanes

• Kingdom: Organic compounds
• Superclass: Organometallic compounds
• Class: Organometalloid compounds
• Subclass: Organosilicon compounds
• Intermediate Tree Nodes: Organoheterosilanes - Trialkylheterosilanes
• Direct Parent: Trialkylchlorosilanes
• Alternative Parents: Silyl monohalides Organochlorosilanes Organic metalloid salts Alkylhalosilanes Hydrocarbon derivatives
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Trialkylchlorosilane - Silyl monohalide - Organochlorosilane - Organic metalloid salt - Alkylhalosilane - Hydrocarbon derivative - Aliphatic acyclic compound
• Description: This compound belongs to the class of organic compounds known as trialkylchlorosilanes. These are organoheterosilanes, bearing a silicon atom linked to three alkyl groups and one chlorine atom.
• 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；Light sensitive
• Refractive Index: n20/D 1.459 (lit.)
• Flash Point(°F): 235.4 °F
• Flash Point(°C): 113 °C
• Boil Point(°C): 140-170 °C/0.05 mmHg (lit.)
• Molecular Weight: 431.300 g/mol
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 0
• Rotatable Bond Count: 21
• Exact Mass: 430.376 Da
• Monoisotopic Mass: 430.376 Da
• Topological Polar Surface Area: 0.000 Ų
• Heavy Atom Count: 28
• Formal Charge: 0
• Complexity: 304.000
• 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

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