3-Azido-1-propanol - ≥96% , CAS No.72320-38-8

CAS: 72320-38-8 Cat. No.: A464136 Molecular Weight: 101.11 EC Number: 804-177-2

GRADE & PURITY ≥96%

Synonyms

EN300-54802 | BP-26351 | WHVSIWLMCCGHFW-UHFFFAOYSA-N | HY-151851 | F8880-4710 | AS-81878 | F87566 | LCZC1123 | 3-Azido-1-propanol, >=96% | DTXSID20451131 | SCHEMBL13569664 | MFCD14652506 | 3-Azido-alcohol | A902850 | C3H7N3O | 3-azidopropanol | AKOS010633

Storage

Store at 2-8°C,Protected from light,Argon charged

Shipped In

Wet ice

Overview

Description

Small chain azido-alcohol for click chemistry applications.3-Azido-1-propanol can be used as a building block for the synthesis of:Tris-(hydroxypropyltriazolylmethyl)amine (THPTA) which acts as a stabilizing ligand for Cu(I) to protect it from oxidation and disproportionation in “click” copolymerization.Heterofunctional polyesters by 1,3-dipolar cycloaddition reaction.Azide-containing cross-linkers.

Specifications

Synonyms

EN300-54802 | BP-26351 | WHVSIWLMCCGHFW-UHFFFAOYSA-N | HY-151851 | F8880-4710 | AS-81878 | F87566 | LCZC1123 | 3-Azido-1-propanol, >=96% | DTXSID20451131 | SCHEMBL13569664 | MFCD14652506 | 3-Azido-alcohol | A902850 | C3H7N3O | 3-azidopropanol | AKOS010633

Specifications & Purity

≥96%

Storage

Store at 2-8°C, Protected from light, Argon charged

Shipped In

Wet ice

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

Purity

≥96%

Names and Identifiers

• Canonical Smiles: C(CN=[N+]=[N-])CO
• IUPAC Name: 3-azidopropan-1-ol
• InChIKey: WHVSIWLMCCGHFW-UHFFFAOYSA-N
• INCHI: 1S/C3H7N3O/c4-6-5-2-1-3-7/h7H,1-3H2
• Isomeric SMILES: C(CN=[N+]=[N-])CO
• Molecular Weight: 101.11
• Reaxy-Rn: 1754419
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1754419&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic 1,3-dipolar compounds
    • Class Allyl-type 1,3-dipolar organic compounds
      • Subclass Azo imides

• Kingdom: Organic compounds
• Superclass: Organic 1,3-dipolar compounds
• Class: Allyl-type 1,3-dipolar organic compounds
• Subclass: Azo imides
• Intermediate Tree Nodes: Not available
• Direct Parent: Azo imides
• Alternative Parents: Azo compounds Alkanolamines Primary alcohols Organic zwitterions Organic salts Hydrocarbon derivatives
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Azo imide - Azo compound - Alkanolamine - Organic nitrogen compound - Organic oxygen compound - Hydrocarbon derivative - Organic salt - Organic zwitterion - Primary alcohol - Organooxygen compound - Organonitrogen compound - Alcohol - Aliphatic acyclic compound
• Description: This compound belongs to the class of organic compounds known as azo imides. These are n-Imides of azo compounds, analogous to azoxy compounds, having a delocalized structure.
• 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: light and moisture and heat sensitive
• Refractive Index: 1.461
• Flash Point(°F): 190.0 °F
• Flash Point(°C): 87.77 °C
• Molecular Weight: 101.110 g/mol
• XLogP3: 0.800
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 3
• Exact Mass: 101.059 Da
• Monoisotopic Mass: 101.059 Da
• Topological Polar Surface Area: 34.600 Ų
• Heavy Atom Count: 7
• Formal Charge: 0
• Complexity: 76.200
• 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