Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: 4H-1-Benzopyran-4-one, 7-(hexyloxy)-3-phenoxy-
RN: 137460-58-3
InChIKey: VKVHGBWCULITLM-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C21-H22-O4

Molecular Weight

  • 338.4008
 
* denotes mobile formatted website

Links to Resources

NLM Resources (File Locators)

Other Resources (Internet Locators)


Search for this InChIKey on the Web

Names and Synonyms

Synonyms

  • 7-(Hexyloxy)-3-phenoxy-4H-1-benzopyran-4-one
  • BRN 5353819

Systematic Name

  • 4H-1-Benzopyran-4-one, 7-(hexyloxy)-3-phenoxy-

Registry Numbers

CAS Registry Number

  • 137460-58-3

System Generated Number

  • 0137460583

Structure Descriptors

InChI

1S/C21H22O4/c1-2-3-4-8-13-23-17-11-12-18-19(14-17)24-15-20(21(18)22)25-16-9-6-5-7-10-16/h5-7,9-12,14-15H,2-4,8,13H2,1H3

InChIKey

VKVHGBWCULITLM-UHFFFAOYSA-N

Smiles

CCCCCCOc1ccc2c(c1)occ(c2=O)Oc3ccccc3

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal > 200mg/kg (200mg/kg)   Pharmaceutical Chemistry Journal Vol. 25, Pg. 470, 1991.