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Substance Name: Cotoin
RN: 479-21-0
UNII: Z8618Z93DA
InChIKey: HNJZOHHIXSIJFG-UHFFFAOYSA-N

Classification Code

  • Natural Product

Molecular Formula

  • C14-H12-O4

Molecular Weight

  • 244.2448
 
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Names and Synonyms

Name of Substance

  • Cotoin

Synonyms

  • (2,6-Dihydroxy-4-methoxyphenyl)phenylmethanone
  • 2,6-Dihydroxy-4-methoxybenzophenone
  • 4-08-00-03163 (Beilstein Handbook Reference)
  • BRN 1981817
  • Cotoin
  • Monomethyl ether of 2,4,6-trihydroxybenzophenone
  • Monomethylaether der 2,4,6-trioxybenzophenon
  • Monomethylaether der 2,4,6-trioxybenzophenon [German]
  • UNII-Z8618Z93DA

Systematic Names

  • Benzophenone, 2,6-dihydroxy-4-methoxy-
  • Methanone, (2,6-dihydroxy-4-methoxyphenyl)phenyl- (9CI)

Registry Numbers

CAS Registry Number

  • 479-21-0

FDA UNII

  • Z8618Z93DA

System Generated Number

  • 0000479210

Structure Descriptors

InChI

1S/C14H12O4/c1-18-10-7-11(15)13(12(16)8-10)14(17)9-5-3-2-4-6-9/h2-8,15-16H,1H3

InChIKey

HNJZOHHIXSIJFG-UHFFFAOYSA-N

Smiles

COc1cc(O)c(C(=O)c2ccccc2)c(O)c1

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
frog LDLo subcutaneous 242mg/kg (242mg/kg) BEHAVIORAL: CHANGES IN MOTOR ACTIVITY (SPECIFIC ASSAY)

LUNGS, THORAX, OR RESPIRATION: OTHER CHANGES

CARDIAC: CHANGE IN FORCE OF CONTRACTION
Biochemische Zeitschrift. Vol. 74, Pg. 340, 1916.

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point 130.5 deg C   EXP
log P (octanol-water) 3.820 (none)   EST
Atmospheric OH Rate Constant 2.01E-10 cm3/molecule-sec 25 EST

Physical property data is provided to ChemIDplus by SRC, Inc.