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Substance Name: Benzoic acid, 2-hydroxy-, 1,4-dioxaspiro(4.5)dec-2-ylmethyl ester
RN: 59902-29-3
InChIKey: IGVQTQOASBTUOX-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C16-H20-O5

Molecular Weight

  • 292.329
 
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Names and Synonyms

Synonyms

  • (1,4-Dioxaspiro(4.5)dec-2-yl)methyl o-hydroxybenzoate
  • 1,4-Dioxaspiro(4.5)dec-2-ylmethyl 2-hydroxybenzoate
  • o-Hydroxybenzoic acid (1,4-dioxaspiro(4.5)dec-2-yl)methyl ester

Systematic Name

  • Benzoic acid, 2-hydroxy-, 1,4-dioxaspiro(4.5)dec-2-ylmethyl ester

Registry Numbers

CAS Registry Number

  • 59902-29-3

System Generated Number

  • 0059902293

Structure Descriptors

InChI

1S/C16H20O5/c17-14-7-3-2-6-13(14)15(18)19-10-12-11-20-16(21-12)8-4-1-5-9-16/h2-3,6-7,12,17H,1,4-5,8-11H2

InChIKey

IGVQTQOASBTUOX-UHFFFAOYSA-N

Smiles

c1ccc(c(c1)C(=O)OCC2COC3(O2)CCCCC3)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal > 2gm/kg (2000mg/kg) SENSE ORGANS AND SPECIAL SENSES: PTOSIS: EYE

LUNGS, THORAX, OR RESPIRATION: RESPIRATORY DEPRESSION

BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY)
Pharmazie. Vol. 31, Pg. 317, 1976.
mouse LD50 oral > 2gm/kg (2000mg/kg)   Pharmazie. Vol. 31, Pg. 317, 1976.