3-Ethoxypropylamine - ≥98%(GC)(T) , CAS No.6291-85-6

CAS: 6291-85-6 Cat. No.: E156297 Formula: C₅H₁₃NO Molecular Weight: 103.17 Beilstein Registry Number: 1732290 EC Number: 228-545-1

GRADE & PURITY ≥98%(GC)(T)

Synonyms

3-Ethoxypropylamine, analytical standard | NSC 8162 | SCHEMBL11125194 | VS-08579 | AKOS000120252 | 3-Ethoxypropylamine, 99% | EINECS 228-545-1 | FT-0615639 | 3-Ethoxypropylamine | 3-Ethoxy-propylamine | PROPYLAMINE, 3-ETHOXY- | Integrase inhibitor, R3{4}

Storage

Room temperature,Argon charged,Desiccated

Shipped In

Normal

Overview

It was used to partially open the rigid oxetane chain, during the synthesis of oxetane-based oligomers, to generate some specific properties.

Specifications

Synonyms

3-Ethoxypropylamine, analytical standard | NSC 8162 | SCHEMBL11125194 | VS-08579 | AKOS000120252 | 3-Ethoxypropylamine, 99% | EINECS 228-545-1 | FT-0615639 | 3-Ethoxypropylamine | 3-Ethoxy-propylamine | PROPYLAMINE, 3-ETHOXY- | Integrase inhibitor, R3{4}

Specifications & Purity

≥98%(GC)(T)

Storage

Room temperature,Argon charged,Desiccated

Shipped In

Normal

Purity

≥98%(GC)(T)

Product Line

E156297-25ml

Names and Identifiers

Pubchem Sid

488182779

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/488182779

Canonical Smiles

CCOCCCN

IUPAC Name

3-ethoxypropan-1-amine

InChIKey

SOYBEXQHNURCGE-UHFFFAOYSA-N

INCHI

1S/C5H13NO/c1-2-7-5-3-4-6/h2-6H2,1H3

Isomeric SMILES

CCOCCCN

WGK Germany

1

RTECS

UI2700000

UN Number

2734

Packing Group

II

Molecular Weight

103.17

Beilstein

1732290

Reaxy-Rn

1732287

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1732287&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic oxygen compounds
    • Class Organooxygen compounds
      • Subclass Ethers

• Kingdom: Organic compounds
• Superclass: Organic oxygen compounds
• Class: Organooxygen compounds
• Subclass: Ethers
• Intermediate Tree Nodes: Not available
• Direct Parent: Dialkyl ethers
• Alternative Parents: Organopnictogen compounds Monoalkylamines Hydrocarbon derivatives
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Dialkyl ether - Organic nitrogen compound - Organopnictogen compound - Hydrocarbon derivative - Primary amine - Organonitrogen compound - Primary aliphatic amine - Amine - Aliphatic acyclic compound
• Description: This compound belongs to the class of organic compounds known as dialkyl ethers. These are organic compounds containing the dialkyl ether functional group, with the formula ROR', where R and R' are alkyl groups.
• 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: Miscible in water.
• Sensitivity: air sensitive
• x_refractive_index: 1.418
• x_flash_point_drop_fahrenheit: 91.4 °F
• x_flash_point_drop_centigrade: 33 °C
• x_boil_point_char: 136-138 °C
• Molecular Weight: 103.160 g/mol
• XLogP3: -0.100
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 4
• Exact Mass: 103.1 Da
• Monoisotopic Mass: 103.1 Da
• Topological Polar Surface Area: 35.300 Ų
• Heavy Atom Count: 7
• Formal Charge: 0
• Complexity: 31.300
• 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

Frequently Asked Questions

What is the purity of this product, and how is it determined?

This product is supplied at ≥98% purity, determined by gas chromatography (GC). Lot-specific values are stated on the Certificate of Analysis.

How should this product be stored?

Store in a cool place, desiccated, 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 6291-85-6, the molecular formula is C5H13NO, and the molecular weight is 103.17 g/mol. InChIKey SOYBEXQHNURCGE-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.