3-Butyn-2-ol - 55% in water , CAS No.2028-63-9

CAS: 2028-63-9 Cat. No.: B301756 Peso molecular: 70.09 Beilstein Registry Number: 1(4)2218 Número EC: 217-978-1

GRADE & PURITY 55% in water

Synonyms

3-Butyn-2-ol|but-3-yn-2-ol|2028-63-9|3-Butyne-2-ol|3-Hydroxy-1-butyne|1-BUTYN-3-OL|1-Methylpropargyl alcohol|Methylethynylcarbinol|1-Ethynylethanol|1-Methyl-2-propynyl alcohol|65337-13-5|.alpha.-Methylpropargyl alcohol|(+/-)-3-butyn-2-ol|Ethynylmethylcarb

Storage

Store at 2-8°C

Shipped In

Wet ice,FedEx DG Service

Specifications

Sinónimos

3-Butyn-2-ol | but-3-yn-2-ol | 2028-63-9 | 3-Butyne-2-ol | 3-Hydroxy-1-butyne | 1-BUTYN-3-OL | 1-Methylpropargyl alcohol | Methylethynylcarbinol | 1-Ethynylethanol | 1-Methyl-2-propynyl alcohol | 65337-13-5 | .alpha.-Methylpropargyl alcohol | (+/-)-3-butyn-2-ol | Ethynylmethylcarb

Especificaciones y pureza

55% in water

Condiciones de almacenamiento de almacenamiento

Store at 2-8°C

Enviado en

Wet ice, FedEx DG Service

Este producto requiere envío en cadena de frío. Los servicios terrestres y otros servicios económicos no están disponibles.

Nombres e identificadores

• Pubchem Sid: 504752736
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/504752736
• Sonrisas canónicas: CC(C#C)O
• IUPAC Name: but-3-yn-2-ol
• InChIKey: GKPOMITUDGXOSB-UHFFFAOYSA-N
• INCHI: 1S/C4H6O/c1-3-4(2)5/h1,4-5H,2H3
• Isómeros SMILES: CC(C#C)O
• WGK Alemania: 3
• RTECS: ES0709800
• Número ONU: 2929
• Grupo de embalaje: II
• Peso molecular: 70.09
• Beilstein: 1(4)2218
• Reaxy-Rn: 635722
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=635722&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic oxygen compounds
    • Clase Organooxygen compounds
      • Subclass Alcohols and polyols

• Kingdom: Organic compounds
• Superclass: Organic oxygen compounds
• Clase: Organooxygen compounds
• Subclass: Alcohols and polyols
• Intermediate Tree Nodes: Not available
• Direct Parent: Secondary alcohols
• Alternative Parents: Acetylides Hydrocarbon derivatives
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Secondary alcohol - Acetylide - Hydrocarbon derivative - Aliphatic acyclic compound
• Descripción: This compound belongs to the class of organic compounds known as secondary alcohols. These are compounds containing a secondary alcohol functional group, with the general structure HOC(R)(R') (R,R'=alkyl, aryl).
• 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

Propiedades químicas y físicas

• Índice de refracción: 1.425-1.427
• Punto de inflamación (°C): 34℃
• Punto de ebullición (°C): 66-67 °C/150 mmHg
• Peso molecular: 70.090 g/mol
• XLogP3: 0.100
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 0
• Exact Mass: 70.0419 Da
• Monoisotopic Mass: 70.0419 Da
• Topological Polar Surface Area: 20.200 Ų
• Heavy Atom Count: 5
• Formal Charge: 0
• Complexity: 57.300
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• Undefined Atom Stereocenter Count: 1
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 0
• Covalently-Bonded Unit Count: 1

Referencias

1. Zhengyuan Zhang, Yu Liu, Xiaochuan Shui, Youqing Yu, Chunyan Zheng, Yuechuan Wang.  (2021)  Free radical polymerization of acrylates bearing acetylene for preparation of clickable polymers.  POLYMER,      [PMID:] [10.1016/j.polymer.2021.123906]

2. Ji Xiaoli, Chen Fan, Liu Jian, Ma Qianqian, Qiao Ruochen, Xu Zhihao.  (2024)  Synthesis of MWCNTs/Si3N4 Nanocomposites Via Click Chemistry and Electromagnetic Wave-Absorption Properties.  JOURNAL OF ELECTRONIC MATERIALS,      [PMID:] [10.1007/s11664-024-11601-z]

3. Ji Xiaoli, Ma Qianqian, Liu Jian, Yuan Haoze, Ma Xukai.  (2024)  Synthesis of TiO2/MWCNTs nanocomposites by click chemistry and its microwave absorption properties.  BULLETIN OF MATERIALS SCIENCE,  47  (3): (1-13).  [PMID:] [10.1007/s12034-024-03250-z]

4. Xiaoli Ji, Fan Chen, Jian Liu, Qianqian Ma, Zhihao Xu, Ruochen Qiao.  (2025)  Preparation of MWCNTs/Si3N4/PPy ternary composites via click chemistry and wave-absorbing properties.  VACUUM,      [PMID:] [10.1016/j.vacuum.2025.114570]

5. Yun Fang, Yong Yan, Xiayan Wang, Guangsheng Guo.  (2025)  Bimetallic PdCu nanohybrid sheets for enhanced electrocatalytic selective semi-hydrogenation of alkynols.  CHEMICAL ENGINEERING JOURNAL,      [PMID:] [10.1016/j.cej.2025.164620]