Selinidin

CAS Registry Number®

19427-82-8
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CAS Name

Selinidin

Molecular Formula

C19H20O5

Molecular Mass

328.36

Cite this Page

Selinidin.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=19427-82-8 (retrieved 2024-08-27) (CAS RN: 19427-82-8).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    97-98 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C19H20O5/c1-5-11(2)18(21)22-15-10-13-14(24-19(15,3)4)8-6-12-7-9-16(20)23-17(12)13/h5-9,15H,10H2,1-4H3/b11-5-/t15-/m0/s1

InChIKey

InChIKey=RRHCDWLSHIIIIT-GHAIFCDISA-N

SMILES

O(C(/C(=C\C)/C)=O)[C@H]1CC=2C3=C(C=CC2OC1(C)C)C=CC(=O)O3

Canonical SMILES

O=C1OC2=C(C=C1)C=CC=3OC(C)(C)C(OC(=O)C(=CC)C)CC32

Other Names for this Substance

  • 2-Butenoic acid, 2-methyl-, (9S)-9,10-dihydro-8,8-dimethyl-2-oxo-2H,8H-benzo[1,2-b:3,4-b′]dipyran-9-yl ester, (2Z)-
  • Crotonic acid, 2-methyl-, ester with 9,10-dihydro-9-hydroxy-8,8-dimethyl-2H,8H-benzo[1,2-b:3,4-b′]dipyran-2-one, (Z)-(S)-
  • 2-Butenoic acid, 2-methyl-, 9,10-dihydro-8,8-dimethyl-2-oxo-2H,8H-benzo[1,2-b:3,4-b′]dipyran-9-yl ester, [S-(Z)]-
  • 2H,8H-Benzo[1,2-b:3,4-b′]dipyran, 2-butenoic acid deriv.
  • Selinidin

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Deleted or Replaced CAS Registry Numbers

1165-60-2, 3848-80-4, 21869-20-5