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Substance Name: Benzoxazole, 2,5-dimethyl-
RN: 5676-58-4
InChIKey: XVQGFGKAPKEUFT-UHFFFAOYSA-N

Molecular Formula

  • C9-H9-N-O

Molecular Weight

  • 147.176
 
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Names and Synonyms

Synonyms

  • 2,5-Dimethylbenzoxazole
  • EINECS 227-136-5
  • NSC 93785

Systematic Names

  • 2,5-Dimethylbenzoxazole
  • Benzoxazole, 2,5-dimethyl-

Registry Numbers

CAS Registry Number

  • 5676-58-4

System Generated Number

  • 0005676584

Structure Descriptors

InChI

1S/C9H9NO/c1-6-3-4-9-8(5-6)10-7(2)11-9/h3-5H,1-2H3

InChIKey

XVQGFGKAPKEUFT-UHFFFAOYSA-N

Smiles

c12c(nc(o1)C)cc(C)cc2

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 56mg/kg (56mg/kg)   U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. Vol. NX#03231,

Physical Properties

Physical Property Value Units Temp (deg C) Source
Boiling Point 218.5 deg C   EXP
log P (octanol-water) 2.810 (none)   EST
Atmospheric OH Rate Constant 2.91E-11 cm3/molecule-sec 25 EST

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