2-Cyanoethyltriethoxysilane - ≥97% , CAS No.919-31-3

CAS: 919-31-3 Cat. No.: C153552 Formula: C₉H₁₉NO₃Si Molecular Weight: 217.34 Beilstein Registry Number: 1776390 EC Number: 213-050-5

GRADE & PURITY ≥97%

Synonyms

AI3-51457 | MFCD00019851 | 3-(TRIETHOXYSILYL)PROPIONITRILE [HSDB] | 3-(TRIETHOXYSILYL)PROPIONITRILE | NCGC00259451-01 | Propionitrile, 3-(triethoxysilyl)- | 3-(Triethoxysilyl)propiononitrile | EINECS 213-050-5 | 3-(Triethoxysilyl)propanenitrile | cyanoeth

Storage

Argon charged,Room temperature

Shipped In

Normal

Overview

It may be coated on quartz and aluminum by the sol-gel process

Specifications

Synonyms

AI3-51457 | MFCD00019851 | 3-(TRIETHOXYSILYL)PROPIONITRILE [HSDB] | 3-(TRIETHOXYSILYL)PROPIONITRILE | NCGC00259451-01 | Propionitrile, 3-(triethoxysilyl)- | 3-(Triethoxysilyl)propiononitrile | EINECS 213-050-5 | 3-(Triethoxysilyl)propanenitrile | cyanoeth

Specifications & Purity

≥97%

Storage

Argon charged,Room temperature

Shipped In

Normal

Purity

≥97%

Names and Identifiers

Pubchem Sid

504752454

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/504752454

Canonical Smiles

CCO[Si](CCC#N)(OCC)OCC

IUPAC Name

3-triethoxysilylpropanenitrile

InChIKey

GBQYMXVQHATSCC-UHFFFAOYSA-N

INCHI

1S/C9H19NO3Si/c1-4-11-14(12-5-2,13-6-3)9-7-8-10/h4-7,9H2,1-3H3

Isomeric SMILES

CCO[Si](CCC#N)(OCC)OCC

WGK Germany

2

RTECS

VV2750000

Molecular Weight

217.34

Beilstein

1776390

Reaxy-Rn

1776392

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1776392&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organometallic compounds
    • Class Organometalloid compounds
      • Subclass Organosilicon compounds
        • Level5 Alkoxysilanes
          • Level6 Trialkoxysilanes

• Kingdom: Organic compounds
• Superclass: Organometallic compounds
• Class: Organometalloid compounds
• Subclass: Organosilicon compounds
• Intermediate Tree Nodes: Alkoxysilanes
• Direct Parent: Trialkoxysilanes
• Alternative Parents: Silyl ethers Organoheterosilanes Organic metalloid salts Nitriles Organopnictogen compounds Organooxygen compounds Hydrocarbon derivatives
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Trialkoxysilane - Silyl ether - Organoheterosilane - Organic metalloid salt - Nitrile - Carbonitrile - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Hydrocarbon derivative - Organic salt - Organooxygen compound - Organonitrogen compound - Aliphatic acyclic compound
• Description: This compound belongs to the class of organic compounds known as trialkoxysilanes. These are organosilicon compounds with the general formula RO[Si](R')(OR'')OR''' (R-R''' = aliphatic organyl group).
• 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

• Solubility: Hydrolyzes in water.
• Sensitivity: Moisture sensitive
• Refractive Index: 1.41
• Flash Point(°F): 212 °F
• Flash Point(°C): 86°C(lit.)
• Boil Point(°C): 137°C/29mmHg(lit.)
• Molecular Weight: 217.340 g/mol
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 8
• Exact Mass: 217.113 Da
• Monoisotopic Mass: 217.113 Da
• Topological Polar Surface Area: 51.500 Ų
• Heavy Atom Count: 14
• Formal Charge: 0
• Complexity: 173.000
• 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

XLogP3

Frequently Asked Questions

What is the purity of this product?

This product is supplied at ≥97% purity (chemical assay). Lot-specific values are stated on the Certificate of Analysis.

How should this product be stored?

Store at room temperature under argon. It is supplied under an argon blanket; reseal under inert gas after each use.

How is this product shipped?

This product ships under standard ambient conditions. No temperature-controlled packaging is required.

What are the CAS number, molecular formula and molecular weight?

The CAS Number is 919-31-3, the molecular formula is C9H19NO3Si, and the molecular weight is 217.34 g/mol. InChIKey GBQYMXVQHATSCC-UHFFFAOYSA-N.

What documentation is provided?

Available product documentation, including Certificates of Analysis (COA), Safety Data Sheets (SDS), and specification sheets, is shown in the product document area. Document availability and access follow the current site policy.