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Substance Name: Indanofan [ISO]
RN: 133220-30-1
UNII: Z5WQ384U76
InChIKey: PMAAYIYCDXGUAP-UHFFFAOYSA-N

Molecular Formula

  • C20-H17-Cl-O3

Molecular Weight

  • 340.8043
 
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Names and Synonyms

Name of Substance

  • Indanofan [ISO]

Synonyms

  • Indanofan
  • UNII-Z5WQ384U76

Registry Numbers

CAS Registry Number

  • 133220-30-1

FDA UNII

  • Z5WQ384U76

System Generated Number

  • 0133220301

Structure Descriptors

InChI

1S/C20H17ClO3/c1-2-19(17(22)15-8-3-4-9-16(15)18(19)23)11-20(12-24-20)13-6-5-7-14(21)10-13/h3-10H,2,11-12H2,1H3

InChIKey

PMAAYIYCDXGUAP-UHFFFAOYSA-N

Smiles

CCC1(C(=O)c2ccccc2C1=O)CC3(CO3)c4cccc(c4)Cl

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point 61 deg C   EXP
log P (octanol-water) 3.970 (none)   EST
Water Solubility 14 mg/L 25 EXP
Vapor Pressure 2.00E-08 mm Hg 25 EXP
Henry's Law Constant 6.41E-10 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 2.07E-11 cm3/molecule-sec 25 EST

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