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Substance Name: 2-Methyl-3-nitroanisole
RN: 4837-88-1
InChIKey: HQCZLEAGIOIIMC-UHFFFAOYSA-N

Molecular Formula

  • C8-H9-N-O3

Molecular Weight

  • 167.163
 
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Names and Synonyms

Synonym

  • EINECS 225-424-5

Systematic Name

  • 2-Methyl-3-nitroanisole

Registry Numbers

CAS Registry Number

  • 4837-88-1

System Generated Number

  • 0004837881

Structure Descriptors

InChI

1S/C8H9NO3/c1-6-7(9(10)11)4-3-5-8(6)12-2/h3-5H,1-2H3

InChIKey

HQCZLEAGIOIIMC-UHFFFAOYSA-N

Smiles

COc1c(C)c([N+]([O-])=O)ccc1

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point 54-56 deg C   EXP
log P (octanol-water) 2.68 (none)   EXP
Water Solubility 133 mg/L 25 EST
Vapor Pressure 6.65E-03 mm Hg 25 EST
Henry's Law Constant 1.39E-06 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 3.27E-12 cm3/molecule-sec 25 EST

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