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Substance Name: 1-Nitro-4-propylbenzene
RN: 10342-59-3
InChIKey: SXQBFCVVZIYXHV-UHFFFAOYSA-N

Molecular Formula

  • C9-H11-N-O2

Molecular Weight

  • 165.191
 
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Names and Synonyms

Synonym

  • EINECS 233-743-6

Systematic Name

  • 1-Nitro-4-propylbenzene

Registry Numbers

CAS Registry Number

  • 10342-59-3

System Generated Number

  • 0010342593

Structure Descriptors

InChI

1S/C9H11NO2/c1-2-3-8-4-6-9(7-5-8)10(11)12/h4-7H,2-3H2,1H3

InChIKey

SXQBFCVVZIYXHV-UHFFFAOYSA-N

Smiles

[N+](=O)([O-])c1ccc(CCC)cc1

Physical Properties

Physical Property Value Units Temp (deg C) Source
log P (octanol-water) 3.45 (none)   EXP
Water Solubility 29.9 mg/L 25 EST
Vapor Pressure 7.04E-03 mm Hg 25 EST
Henry's Law Constant 4.13E-05 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 3.07E-12 cm3/molecule-sec 25 EST

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