Alpha-Pyrone 2H-吡喃-2-酮

CAS 504-31-4 MFCD00006639

化学结构图

504-31-4
SMILES: O=C1CCCCO1

化学属性

Mol. FormulaC5H4O2
Mol. Weight96.09
Density1.197 g/mL at 25 °C(lit.)
Boiling Point102-103 °C at 20 mmHg
Refractive index1.5270 to 1.5310
Melting Point8-9 °C
Flash Point94°C(lit.)

别名和识别编码

Chemical NameAlpha-Pyrone
Synonym 2H-Pyran-2-one {LY} 2H-Pyran-2-one {} {LY} 2H-Pyran-2-one {} {} {LY} 2H-Pyran-2-one {} {} {} {LY} 2H-Pyran-2-one {} {} {} {} {LY} 2H-Pyran-2-one {} {} {} {} {} {LY} 2H-Pyran-2-one {} {} {} {} {} {} { {} {} {} {} {} {} {LY} 2H-Pyran-2-one {} {} {} {} {} {} {} {LY} 2H-Pyran-2-one {} {} {} {} {} {} {} {} {LY} 2H-Pyran-2-one {} {} {} {} {} {} {} {} {} {LY} 2H-Pyran-2-one {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2H-Pyran-2-one {} {} {} {} {} {} {} {} {} {} {} {LY} 2H-Pyran-2-one {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2H-Pyran-2-one {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2H-Pyran-2-one {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2H-Pyran-2-one {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2H-Pyran-2-one {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {
MDL NumberMFCD00006639
CAS Number504-31-4
PubChem Substance ID68154
Beilstein Registry Number17(5)9,288
EC Number207-990-5
Chemical Name Translation2H-吡喃-2-酮
Reaxys-RN1511
LabNetwork Molecule IDLN01746247
InChIInChI=1S/C5H4O2/c6-5-3-1-2-4-7-5/h1-4H
Canonical SMILESO=C1C=CC=CO1
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分类

  • {uni_hamburg} no charge; oxygen heterocycle; 6RingOnly; 6ring; ester; lactone; 1fragment
  • {SNA} Building Blocks, Chemical Synthesis, Heterocyclic Building Blocks, Pyrans

相关文献及参考

  • Short: II/14a Title: Molecular Constants: Diamagnetic Molecules Author: Demaison, J.; Dubrulle, A.; Hüttner, W.; Tiemann, E. Editor: Hellwege, K.-H.; Hellwege, A.M. Source: Landolt-Börnstein, New Series Volume: II/14a Page: 1-788 Year: 1982 Keyword: organic compounds; molecular constants; spectroscopy; microwave spectroscopy ISBN: 3-540-11365-7 ISBN: 978-3-540-11365-2 Internet Resource: DOI:10.1007/b19966 RefComment: 196 figs., XI
  • Short: II/27B Title: Diamagnetic Susceptibility of Organic Compounds, Oils, Paraffins and Polyethylenes Author: Kumar, M.; Gupta, R. Editor: Gupta, Radha Raman Source: Landolt-Börnstein, New Series Volume: II/27B Year: 2008 Keyword: diamagnetic susceptibility; organic compounds ISBN: 978-3-540-44359-9 (print) ISBN: 978-3-540-45860-9 (online) Internet Resource: doi:10.1007/978-3-540-45860-9 RefComment: VIII, 503 p. With CD-ROM., Hardcover RefComment: Written for: Scientists and researchers in the fields of physics, chemistry, materials science RefComment: Supplement and Revised Editon to II/16 Abstract: The volume II/27 has been divided into three subvolumes according to the classes of compounds: Subvolume A: Diamagnetic susceptibility and magnetic anisotropy of inorganic and organometallic compounds; Subvolume B: Diamagnetic susceptibility of organic compounds, oils, paraffins and polyethylenes; Subvolume C: Diamagnetic susceptibility and magnetic anisotropy of organic compounds. The data presented in this volume are based on the literature survey of the chemical abstracts up to 2005. The calculated values of diamagnetic susceptibility of organic compounds in the present subvolume II/27B are presented along with their experimental values. They have been calculated with the use of structural parameters in structural formula by using different theoretical methods available in the literature.
  • Short: II/27C Title: Diamagnetic Susceptibility and Magnetic Anisotropy of Organic Compounds Author: Kumar

安全信息

WGK Germany3
Personal Protective Equipment Eyeshields, Gloves
GHS Symbol
Safety Statements
Precautionary statements
Storage condition 2-8°C, stored under nitrogen {LY} 2-8°C, stored under nitrogen {} {LY} 2-8°C, stored under nitrogen {} {} {LY} 2-8°C, stored under nitrogen {} {} {} {LY} 2-8°C, stored under nitrogen {} {} {} {} {LY} 2-8°C, stored under nitrogen {} {} {} {} {} {LY} 2-8°C, stored under nitrogen {} {} {} {} {} {} {LY} 2-8°C, stored under nitrogen {} {} {} {} {} {} {} {LY} 2-8°C, stored under nitrogen {} {} {} {} {} {} {} {} {LY} 2-8°C, stored under nitrogen {} {} {} {} {} {} {} {} {} {LY} 2-8°C, stored under nitrogen {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C, stored under nitrogen {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C, stored under nitrogen {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C, stored under nitrogen {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C, stored under nitrogen {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C, stored under nitrogen {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C, stored under nitro

系列性分类


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