Benzene, 1-allyl-2,3-dimethoxy-4,5-(methylenedioxy)- 6-烯丙基-4,5-二甲氧基苯并[d][1,3]二恶唑

CAS 484-31-1 MFCD00210045

化学结构图

484-31-1
SMILES: C=CCc1cc2c(c(OC)c1OC)OCO2

化学属性

Mol. FormulaC12H14O4
Mol. Weight222.24
Refractive indexn20/D 1.533
Density1.163 g/mL at 20 °C(lit.)
Melting Point29.5 °C
Boiling Point285 °C at 760 mmHg

别名和识别编码

Chemical NameBenzene, 1-allyl-2,3-dimethoxy-4,5-(methylenedioxy)-
Synonym Dill apiole {LY} Dill apiole {} {LY} Dill apiole {} {} {LY} Dill apiole {} {} {} {LY} Dill apiole {} {} {} {} {LY} Dill apiole {} {} {} {} {} {LY} Dill apiole {} {} {} {} {} {} { {} {} {} {} {} {} {LY} Dill apiole {} {} {} {} {} {} {} {LY} Dill apiole {} {} {} {} {} {} {} {} {LY} Dill apiole {} {} {} {} {} {} {} {} {} {LY} Dill apiole {} {} {} {} {} {} {} {} {} {} {LY} Dill apiole {} {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {} {LY} Dill apiole {} {} {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {} {} {LY} Dill apiole {} {} {} {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Dill apiole {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Dill apiole {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Dill apiole {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Dill apiole {} {} {} {} {} {} {} {} {} {} {
MDL NumberMFCD00210045
PubChem Substance ID10231
Beilstein Registry Number0196037
CAS Number484-31-1
Chemical Name Translation6-烯丙基-4,5-二甲氧基苯并[d][1,3]二恶唑
InChIInChI=1S/C12H14O4/c1-4-5-8-6-9-11(16-7-15-9)12(14-3)10(8)13-2/h4,6H,1,5,7H2,2-3H3
Canonical SMILESO(C1=C(OC)C(=CC=2OCOC21)CC=C)C
信息真实价格透明    资金保障    专业采购外包团队在线服务   
信息真实价格透明    资金保障    专业采购外包团队在线服务   
品牌质保精细包装    现货库存    一流品牌服务   

分类

  • {uni_hamburg} no charge; oxygen heterocycle; carbocycle; aromatic; alicycle; large ring; fused rings; 5ring; 6ring; 9ring; ether; 1fragment

相关文献及参考

  • Short: III/35C3 Title: Nuclear Magnetic Resonance (NMR) Data: Chemical Shifts and Coupling Constants for Hydrogen-1, Part 3: Natural Compounds Author: Gupta, R.R.; Dobhal, M.P. Editor: Gupta, R.R.; Lechner, M.D. Source: Landolt-Börnstein, New Series Volume: III/35C3 Year: 2003 Keyword: chemical shift; coupling constant; molecular structure ISBN: 3-540-41058-9 ISBN: 978-3-540-41058-4 Internet Resource: DOI:10.1007/b76569 RefComment: VIII, 322 pages. With CD-ROM. Hardcover Abstract: This volume provides a comprehensive and evaluated compilation of nuclear magnetic resonance data. Chemical shifts and coupling constants of boron-11 and phosphorus-31 (subvol. A), fluorine-19 and nitrogen-15 (subvol. B), hydrogen-1 (subvol. C), and carbon-13 (subvol. D) compounds are tabulated together with the gross- and structure formulas and the most readily available solvents. Due to the large amount of the data merely chemical shifts are presented in the printed versions, and all the data, chemical shifts and coupling constants are provided on CD-ROM's.
  • Short: III/35D4 Title: Nuclear Magnetic Resonance (NMR) Data: Chemical Shifts for Carbon-13, Part 4: Natural Products Author: Dobhal, M.P. Editor: Gupta, R.R.; Lechner, M.D. Source: Landolt-Börnstein, New Series Volume: III/35D4 Year: 2006 Keyword: aromatic compounds; carbon-13; chemical shift; coupling constant; molecular structure ISBN: 978-3-540-29732-1 ISBN: 3-540-29732-4 Internet Resource: DOI:10.1007/b13179 RefComment: VIII, 417 p., 1925 illus., Hardcover RefComment: Written for Scientists and engineers in the fields of physics, chemistry and physical chemistry who intend to use NMR to study the structure and the binding of molecules Abstract: Nuclear Magnetic Resonance (NMR) is based on the fact that certain nuclei exhibit a magnetic moment, oriented by a magnetic field, and absorb characteristic frequencies in the radiofrequency part of the spectrum. The spectral lines of the nuclei are highl

安全信息

RTECSCY2490000
Hazard statements
  • H302 Harmful if swallowed 吞食有害
WGK Germany3
Signal word Warning
GHS Symbol
Personal Protective Equipment Eyeshields, Faceshields, full-face respirator (US), Gloves, multi-purpose combination respirator cartridge (US), type ABEK (EN14387) respirator filter 
TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 1 gm/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   IJPAAO Indian Journal of Pharmacy.  (Bombay, India)  V.1-40(1), 1939-78. For
   publisher information, see IJSIDW.  Volume(issue)/page/year: 34,69,1972

TYPE OF TEST            : DNA adduct
ROUTE OF EXPOSURE       : Intraperitoneal
TEST SYSTEM             : Rodent - mouse
DOSE/DURATION           : 400 mg/kg
REFERENCE :
   CRNGDP Carcinogenesis (London). (Oxford Univ. Press, Pinkhill House,
   Southfield Road, Eynsham, Oxford OX8 1JJ, UK)  V.1-    1980-
   Volume(issue)/page/year: 5,1613,1984

Storage condition

系列性分类

相关产品推荐