3-[1-[4-(2-Chloroethyl)phenyl]butyl]-4-hydroxy-2H-1-benzopyran-2-one

CAS Registry Number®

35838-63-2
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CAS Name

3-[1-[4-(2-Chloroethyl)phenyl]butyl]-4-hydroxy-2H-1-benzopyran-2-one

Molecular Formula

C21H21ClO3

Molecular Mass

356.84

Cite this Page

3-[1-[4-(2-Chloroethyl)phenyl]butyl]-4-hydroxy-2H-1-benzopyran-2-one.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=35838-63-2 (retrieved 2024-05-15) (CAS RN: 35838-63-2).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C21H21ClO3/c1-2-5-16(15-10-8-14(9-11-15)12-13-22)19-20(23)17-6-3-4-7-18(17)25-21(19)24/h3-4,6-11,16,23H,2,5,12-13H2,1H3

InChIKey

InChIKey=XEBSDNCEYSPGIU-UHFFFAOYSA-N

SMILES

C(CCC)(C1=C(O)C=2C(OC1=O)=CC=CC2)C3=CC=C(CCCl)C=C3

Canonical SMILES

O=C1OC=2C=CC=CC2C(O)=C1C(C3=CC=C(C=C3)CCCl)CCC

Other Names for this Substance

  • 2H-1-Benzopyran-2-one, 3-[1-[4-(2-chloroethyl)phenyl]butyl]-4-hydroxy-
  • 3-[1-[4-(2-Chloroethyl)phenyl]butyl]-4-hydroxy-2H-1-benzopyran-2-one
  • 3-[1-(p-Chlorethylphenyl)butyl]-4-hydroxycoumarin
  • 3[1-[p-(2-Chloroethyl)phenyl]butyl]-4-hydroxycoumarin
  • DB 112

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