Butyramide - ≥98%(GC), used for Butyramide was used in the synthesis of hydroxamic acids, electrorheological fluids and β-amodoorganotin compounds. It was used as substrate of (+)-γ-lactamase to develop a microreactor to study enzyme stability, activity,

CAS: 541-35-5 Cat. No.: B152329 分子式: C₄H₉NO 分子量: 87.12 Beilstein Registry Number: 1361530 EC番号: 208-776-4

GRADE & PURITY ≥98%(GC)

Synonyms

Butyramide, >=98.0% (T) | FT-0623345 | 9J6OR937VR | FEMA NO. 4252 | DNSISZSEWVHGLH-UHFFFAOYSA- | butyrylamide | DTXSID8060248 | Butyramid | NSC 8424 | B0809 | n-butanamide | AI3-24199 | LMFA08010018 | EN300-61108 | C3H7C(O)NH2 | n-Butyramide | UNII-9J6OR9

Storage

Room temperature

Shipped In

Normal

Specifications

同義語

Butyramide, >=98.0% (T) | FT-0623345 | 9J6OR937VR | FEMA NO. 4252 | DNSISZSEWVHGLH-UHFFFAOYSA- | butyrylamide | DTXSID8060248 | Butyramid | NSC 8424 | B0809 | n-butanamide | AI3-24199 | LMFA08010018 | EN300-61108 | C3H7C(O)NH2 | n-Butyramide | UNII-9J6OR9

仕様と純度

≥98%(GC)

申し込み

Butyramide was used in the synthesis of hydroxamic acids, electrorheological fluids and β-amodoorganotin compounds. It was used as substrate of (+)-γ-lactamase to develop a microreactor to study enzyme stability, activity, kinetics and substrate specifici

保管条件

Room temperature

入荷

Normal

純度

≥98%(GC)

名前と識別子

• パブケム・シド: 504752032
• パブケム・シド・ウル: https://pubchem.ncbi.nlm.nih.gov/substance/504752032
• カノニカル・スマイル: CCCC(=O)N
• IUPAC Name: butanamide
• InChIKey: DNSISZSEWVHGLH-UHFFFAOYSA-N
• INCHI: 1S/C4H9NO/c1-2-3-4(5)6/h2-3H2,1H3,(H2,5,6)
• 異性体SMILES: CCCC(=O)N
• WGKドイツ: 3
• 分子量: 87.12
• Beilstein: 1361530
• Reaxy-Rn: 1361528
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1361528&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Lipids and lipid-like molecules
    • 分類 Fatty Acyls
      • Subclass Fatty amides

• Kingdom: Organic compounds
• Superclass: Lipids and lipid-like molecules
• 分類: Fatty Acyls
• Subclass: Fatty amides
• Intermediate Tree Nodes: Not available
• Direct Parent: Fatty amides
• Alternative Parents: Primary carboxylic acid amides Organopnictogen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Fatty amide - Primary carboxylic acid amide - Carboxamide group - Carboxylic acid derivative - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Carbonyl group - Aliphatic acyclic compound
• 説明: This compound belongs to the class of organic compounds known as fatty amides. These are carboxylic acid amide derivatives of fatty acids, that are formed from a fatty acid and an amine.
• External Descriptors: a small molecule

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

作用メカニズム

化学的性質と物理的性質

• 沸点（°C）: 216°C(lit.)
• 融点（°C）: 114-117℃
• 分子量: 87.120 g/mol
• XLogP3: -0.200
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 2
• Exact Mass: 87.0684 Da
• Monoisotopic Mass: 87.0684 Da
• Topological Polar Surface Area: 43.100 Ų
• Heavy Atom Count: 6
• Formal Charge: 0
• Complexity: 51.500
• 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

参考文献

1. Houjie Zhang, Youming Chen, Aimin Chu, Hairong Hu, Yuping Zhao.  (2023)  Synthesis of Imidazole-Based Deep Eutectic Solvents as Solid Lubricants: Lubricated State Transition.  Materials,  16  (19): (6579).  [PMID:37834716] [10.3390/ma16196579]