N-[3-(Dimethylamino)propyl]acrylamide - ≥97%(GC)(T), contains 0.5% MEHQ as stabilizer , CAS No.3845-76-9

CAS: 3845-76-9 Cat. No.: N138771 Molecular Weight: 156.23 EC Number: 223-342-4

GRADE & PURITY ≥97%(GC)(T), contains 0.5% MEHQ as stabilizer

Synonyms

N-(3-Dimethylaminopropyl)acrylamide | N-[3-(dimethylamino)propyl]prop-2-enamide | N,N-Dimethylaminopropyl acrylamide

Storage

Store at 2-8°C

Shipped In

Wet ice

Overview

N,N-Dimethylaminopropyl acrylamide

Specifications

Synonyms

N-(3-Dimethylaminopropyl)acrylamide | N-[3-(dimethylamino)propyl]prop-2-enamide | N, N-Dimethylaminopropyl acrylamide

Specifications & Purity

≥97%(GC)(T), contains 0.5% MEHQ as stabilizer

Storage

Store at 2-8°C

Shipped In

Wet ice

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

Purity

≥97%(GC)(T)

Names and Identifiers

• Pubchem Sid: 504755179
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/504755179
• Canonical Smiles: CN(C)CCCNC(=O)C=C
• IUPAC Name: N-[3-(dimethylamino)propyl]prop-2-enamide
• InChIKey: ADTJPOBHAXXXFS-UHFFFAOYSA-N
• INCHI: 1S/C8H16N2O/c1-4-8(11)9-6-5-7-10(2)3/h4H,1,5-7H2,2-3H3,(H,9,11)
• Isomeric SMILES: CN(C)CCCNC(=O)C=C
• Molecular Weight: 156.23
• Reaxy-Rn: 1762317
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1762317&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic acids and derivatives
    • Class Carboxylic acids and derivatives
      • Subclass Acrylic acids and derivatives

• Kingdom: Organic compounds
• Superclass: Organic acids and derivatives
• Class: Carboxylic acids and derivatives
• Subclass: Acrylic acids and derivatives
• Intermediate Tree Nodes: Not available
• Direct Parent: Acrylic acids and derivatives
• Alternative Parents: Trialkylamines Secondary carboxylic acid amides Amino acids and derivatives Organopnictogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Acrylic acid or derivatives - Amino acid or derivatives - Carboxamide group - Secondary carboxylic acid amide - Tertiary amine - Tertiary aliphatic amine - Amine - Carbonyl group - Organooxygen compound - Organonitrogen compound - Hydrocarbon derivative - Organic oxide - Organic nitrogen compound - Organopnictogen compound - Organic oxygen compound - Aliphatic acyclic compound
• Description: This compound belongs to the class of organic compounds known as acrylic acids and derivatives. These are organic compounds containing acrylic acid CH2=CHCO2H or a derivative thereof.
• 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: Solubility in water: Completely miscible; Soluble in Alcohol,Ether
• Sensitivity: heat sensitive
• Refractive Index: 1.48
• Flash Point(°F): 284 ℉
• Flash Point(°C): 140°C(lit.)
• Boil Point(°C): 142°C/12mmHg
• Molecular Weight: 156.230 g/mol
• XLogP3: 0.500
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 5
• Exact Mass: 156.126 Da
• Monoisotopic Mass: 156.126 Da
• Topological Polar Surface Area: 32.299 Ų
• Heavy Atom Count: 11
• Formal Charge: 0
• Complexity: 132.000
• 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

References

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