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Structure

4H-1-Benzopyran-4-one,2-(3,4-dimethoxyphenyl)-3,5,7-trimethoxy-

CAS
1247-97-8
Catalog Number
ACM1247978
Category
Other Products
Molecular Weight
372.3686
Molecular Formula
C20H20O7

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Specification

Synonyms
3,5,7,3',4'-PENTAMETHOXYFLAVONE;QUERCETIN-3,5,7,3',4'-PENTAMETHYL ETHER;QUERCETIN-3,5,7,3',4';Pentamethoxyquercetin;QUERCETINPENTAMETHYLETHER;PENTAMETHYLQUERCETIN;2-(3,4-Dimethoxyphenyl)-3,5,7-trimethoxy-4H-1-benzopyran-4-one;3,3',4',5,7-Pentamethoxyflav
IUPAC Name
2-(3,4-dimethoxyphenyl)-3,5,7-trimethoxychromen-4-one
Canonical SMILES
COC1=C(C=C(C=C1)C2=C(C(=O)C3=C(C=C(C=C3O2)OC)OC)OC)OC
InChI Key
ALGDHWVALRSLBT-UHFFFAOYSA-N
Boiling Point
561.9ºC at 760 mmHg
Melting Point
152-156ºC
Flash Point
246.9ºC
Density
1.29 g/cm³
Exact Mass
372.12100
H-Bond Acceptor
7
H-Bond Donor
0

Upstream Synthesis Route 1

  • 117-39-5
  • 77-78-1
  • 1247-97-8

Reference: [1]Tatsuzaki, Jin; Ohwada, Tomohiko; Otani, Yuko; Inagi, Reiko; Ishikawa, Tsutomu
[Beilstein Journal of Organic Chemistry, 2018, vol. 14, p. 3112 - 3121]

Upstream Synthesis Route 2

  • 117-39-5
  • 74-88-4
  • 1247-97-8

Reference: [1]Pan, Guojun; Yang, Ke; Ma, Yantao; Zhao, Xia; Lu, Kui; Yu, Peng
[Bulletin of the Korean Chemical Society, 2015, vol. 36, # 5, p. 1460 - 1466]

Downstream Synthesis Route 1

  • 1247-97-8
  • 1244-78-6

Reference: [1]De La Torre, Maria D.L.; Tomé, Augusto C.; Silva, Artur M.S.; Cavaleiro, José A.S.
[Tetrahedron Letters, 2002, vol. 43, # 26, p. 4617 - 4620]
[2]Briggs; Locker
[Journal of the Chemical Society, 1951, p. 3131,3134]

* For details of the synthesis route, please refer to the original source to ensure accuracy.

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