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Substance Name: Spiro(2H-1-benzopyran-3(4H),2'-oxiran)-4-one, 3'-phenyl-
RN: 21733-37-9
InChIKey: HVDVEAXOLCCDGZ-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C16-H12-O3

Molecular Weight

  • 252.268
 
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Names and Synonyms

Synonym

  • 3'-Phenylspiro(2H-1-benzopyran-3(4H),2'-oxiran)-4-one

Systematic Name

  • Spiro(2H-1-benzopyran-3(4H),2'-oxiran)-4-one, 3'-phenyl-

Registry Numbers

CAS Registry Number

  • 21733-37-9

System Generated Number

  • 0021733379

Structure Descriptors

InChI

1S/C16H12O3/c17-14-12-8-4-5-9-13(12)18-10-16(14)15(19-16)11-6-2-1-3-7-11/h1-9,15H,10H2

InChIKey

HVDVEAXOLCCDGZ-UHFFFAOYSA-N

Smiles

C1[C@@]2(C(c3c(O1)cccc3)=O)O[C@@H]2c1ccccc1

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal > 1gm/kg (1000mg/kg)   Indian Journal of Chemistry, Section B: Organic Chemistry, Including Medicinal Chemistry. Vol. 24, Pg. 639, 1985.