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Substance Name: 4H-1-Benzopyran-4-one, 7-(1,5-dimethylhexyl)-3-phenyl-
RN: 146935-07-1
InChIKey: TWAUKAYSROIROR-UHFFFAOYSA-N

Molecular Formula

  • C23-H26-O2

Molecular Weight

  • 334.4564
 
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Names and Synonyms

Synonym

  • 7-(1,5-Dimethylhexyl)-3-phenyl-4H-1-benzopyran-4-one

Systematic Name

  • 4H-1-Benzopyran-4-one, 7-(1,5-dimethylhexyl)-3-phenyl-

Registry Numbers

CAS Registry Number

  • 146935-07-1

System Generated Number

  • 0146935071

Structure Descriptors

InChI

1S/C23H26O2/c1-16(2)8-7-9-17(3)19-12-13-20-22(14-19)25-15-21(23(20)24)18-10-5-4-6-11-18/h4-6,10-17H,7-9H2,1-3H3

InChIKey

TWAUKAYSROIROR-UHFFFAOYSA-N

Smiles

CC(C)CCCC(C)c1ccc2c(c1)occ(c2=O)c3ccccc3

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 2gm/kg (2000mg/kg)   Japanese Kokai Tokyo Koho Patents. Vol. #92-356479,