Oleylamine - technical grade, ≥70% , CAS No.112-90-3

CAS: 112-90-3 Cat. No.: O431504 Formula: C₁₈H₃₇N Molecular Weight: 267.49 Beilstein Registry Number: 1723960 EC Number: 204-015-5

GRADE & PURITY Technical grade, ≥70%

Synonyms

(Z)-octadec-9-en-1-amine | cis-9-Octadecenylamine | (9Z)-9-Octadecen-1-amine

Storage

Argon charged,Room temperature

Shipped In

Normal

Overview

Oleylamine (OAm) is a long chain primary alkyamine, that acts as an electron donor at elevated temperatures. OAm exhibits affinity to metals through NH 2 functional groups. FTIR spectra of OAm has been reported. Oleylamine acts as strong reducing agent as well as a stabilizer in the synthesis of nanoparticle.

Application

Used in the chemical synthesis and capping of nanoparticles such as Fe 3 O 4, poly (2-hydroxyethyl methacrylate)-graft-poly (ε-caprolactone), titania, mesoporous silica.

Specifications

Synonyms

(Z)-octadec-9-en-1-amine | cis-9-Octadecenylamine | (9Z)-9-Octadecen-1-amine

Specifications & Purity

technical grade, ≥70%

Storage

Argon charged,Room temperature

Shipped In

Normal

Grade

Technical grade

Purity

≥70%

Names and Identifiers

• Pubchem Sid: 528772885
• Canonical Smiles: CCCCCCCCC=CCCCCCCCCN
• IUPAC Name: (Z)-octadec-9-en-1-amine
• InChIKey: QGLWBTPVKHMVHM-KTKRTIGZSA-N
• INCHI: 1S/C18H37N/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19/h9-10H,2-8,11-19H2,1H3/b10-9-
• Isomeric SMILES: CCCCCCCC/C=C\CCCCCCCCN
• WGK Germany: 2
• RTECS: RG4130000
• UN Number: 2735
• Packing Group: II
• Molecular Weight: 267.49
• Beilstein: 1723960
• Reaxy-Rn: 1772714
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1772714&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic nitrogen compounds
    • Class Organonitrogen compounds
      • Subclass Amines
        • Level5 Primary amines
          • Level6 Monoalkylamines

• Kingdom: Organic compounds
• Superclass: Organic nitrogen compounds
• Class: Organonitrogen compounds
• Subclass: Amines
• Intermediate Tree Nodes: Primary amines
• Direct Parent: Monoalkylamines
• Alternative Parents: Organopnictogen compounds Hydrocarbon derivatives
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Organopnictogen compound - Hydrocarbon derivative - Primary aliphatic amine - Aliphatic acyclic compound
• Description: This compound belongs to the class of organic compounds known as monoalkylamines. These are organic compounds containing an primary aliphatic amine 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

Associated Targets(non-human)

Galc Galactocerebrosidase (11 Activities)

Discover Target: Galc

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Nfe2l2 Nuclear factor erythroid 2-related factor 2 (214 Activities)

Discover Target: Nfe2l2

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Mechanisms of Action

Chemical and Physical Properties

• Refractive Index: 1.4596
• Flash Point(°F): 309.2 °F
• Flash Point(°C): 154 °C
• Boil Point(°C): 348-350°C
• Melt Point(°C): 18-26°C
• Molecular Weight: 267.500 g/mol
• XLogP3: 7.600
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 15
• Exact Mass: 267.293 Da
• Monoisotopic Mass: 267.293 Da
• Topological Polar Surface Area: 26.000 Ų
• Heavy Atom Count: 19
• Formal Charge: 0
• Complexity: 175.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• Undefined Atom Stereocenter Count: 0
• Defined Bond Stereocenter Count: 1
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 1
• Covalently-Bonded Unit Count: 1