N-tert-Butylacrylamide - ≥97% , CAS No.107-58-4

CAS: 107-58-4 Cat. No.: B109092 Summenformel: C₇H₁₃NO Molekulargewicht: 127.18 Beilstein Registry Number: 1742331 EG-Nummer: 203-505-6

GRADE & PURITY ≥97%

Synonyms

N-t-butyl acrylamide | NCGC00248285-01 | N-TERT-BUTYLACRYLAMIDE | DTXSID1040114 | NSC 5287 | XJ13FSH48K | AKOS005174133 | BRN 1742331 | 4-04-00-00664 (Beilstein Handbook Reference) | N- tertiary Butylacrylamide | Q27293858 | B0703 | N-(tert-Butyl)acrylami

Storage

Room temperature

Shipped In

Normal

Übersicht

description：

N-tert-Butylacrylamide (nTBA) belongs to the class of hydrophobic acrylamides which can be synthesized by Ritter reaction and optimized by using N-tert-butyl acetate and acetic acid. 

application：

nTBA is temperature sensitive monomers that can be potentially used in drug delivery systems, dewatering of proteins, and immobilization of cells. It can be used in the preparation of poly(nTBA) based copolymeric hydrogels for bovin serum albumin.

Specifications

Synonyme

N-t-butyl acrylamide | NCGC00248285-01 | N-TERT-BUTYLACRYLAMIDE | DTXSID1040114 | NSC 5287 | XJ13FSH48K | AKOS005174133 | BRN 1742331 | 4-04-00-00664 (Beilstein Handbook Reference) | N- tertiary Butylacrylamide | Q27293858 | B0703 | N-(tert-Butyl)acrylami

Spezifikationen & Reinheit

≥97%

Storage

Room temperature

Verschickt in

Normal

Reinheit

≥97%

Namen und Kennungen

Pubchem Sid

488180593

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/488180593

Kanonisches Lächeln

CC(C)(C)NC(=O)C=C

IUPAC Name

N-tert-butylprop-2-enamide

InChIKey

XFHJDMUEHUHAJW-UHFFFAOYSA-N

INCHI

1S/C7H13NO/c1-5-6(9)8-7(2,3)4/h5H,1H2,2-4H3,(H,8,9)

Isomere SMILES

CC(C)(C)NC(=O)C=C

WGK Deutschland

3

RTECS

AS3460000

Molekulargewicht

127.18

Beilstein

1742331

Reaxy-Rn

1742331

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1742331&ln=

Taxonomic Classification

Taxonomy Tree

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

• Kingdom: Organic compounds
• Superclass: Organic acids and derivatives
• Klasse: Carboxylic acids and derivatives
• Subclass: Acrylic acids and derivatives
• Intermediate Tree Nodes: Not available
• Direct Parent: Acrylic acids and derivatives
• Alternative Parents: Secondary carboxylic acid amides Organopnictogen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Acrylic acid or derivatives - Secondary carboxylic acid amide - Carboxamide group - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Carbonyl group - Aliphatic acyclic compound
• Beschreibung: 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

Chemische und physikalische Eigenschaften

• Löslichkeit: Solubility in Methanol almost transparency
• Schmelzpunkt (°C): 126-129°C
• Molekulargewicht: 127.180 g/mol
• XLogP3: 1.100
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 2
• Exact Mass: 127.1 Da
• Monoisotopic Mass: 127.1 Da
• Topological Polar Surface Area: 29.100 Ų
• Heavy Atom Count: 9
• Formal Charge: 0
• Complexity: 121.000
• 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

Häufig gestellte Fragen

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.

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 107-58-4, the molecular formula is C7H13NO, and the molecular weight is 127.18 g/mol. InChIKey XFHJDMUEHUHAJW-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.