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Substance Name: 1-(2,5-Dimethoxy-4-nitrophenyl)-2-aminopropane
RN: 67460-68-8
UNII: 3FIV60666J
InChIKey: JQJRESSXOVAECC-UHFFFAOYSA-N

Molecular Formula

  • C11-H16-N2-O4

Molecular Weight

  • 240.257
 
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Names and Synonyms

Name of Substance

  • 1-(2,5-Dimethoxy-4-nitrophenyl)-2-aminopropane

Synonym

  • UNII-3FIV60666J

Systematic Name

  • Benzeneethanamine, 2,5-dimethoxy-alpha-methyl-4-nitro-

Registry Numbers

CAS Registry Number

  • 67460-68-8

FDA UNII

  • 3FIV60666J

System Generated Number

  • 0067460688

Structure Descriptors

InChI

1S/C11H16N2O4/c1-7(12)4-8-5-11(17-3)9(13(14)15)6-10(8)16-2/h5-7H,4,12H2,1-3H3

InChIKey

JQJRESSXOVAECC-UHFFFAOYSA-N

Smiles

C[C@@H](N)Cc1c(OC)cc([N+](=O)[O-])c(OC)c1

Physical Properties

Physical Property Value Units Temp (deg C) Source
log P (octanol-water) 1.74 (none)   EXP
Water Solubility 3630 mg/L 25 EST
Vapor Pressure 1.52E-05 mm Hg 25 EST
Henry's Law Constant 1.49E-11 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 5.19E-11 cm3/molecule-sec 25 EST

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