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Substance Name: 3-Methoxyacetophenone
RN: 586-37-8
UNII: 1K3UR56Z4N
InChIKey: BAYUSCHCCGXLAY-UHFFFAOYSA-N

Molecular Formula

  • C9-H10-O2

Molecular Weight

  • 150.176
 
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Names and Synonyms

Name of Substance

  • 3-Methoxyacetophenone

Synonyms

  • 3'-Methoxyacetophenone
  • 3-Acetylanisole
  • Acetophenone, m-methoxy-
  • AI3-26011
  • EINECS 209-573-3
  • m-Methoxyacetophenone
  • NSC 65593
  • UNII-1K3UR56Z4N

Systematic Names

  • 3-Methoxyacetophenone
  • Acetophenone, 3'-methoxy- (8CI)
  • Ethanone, 1-(3-methoxyphenyl)- (9CI)

Registry Numbers

CAS Registry Number

  • 586-37-8

FDA UNII

  • 1K3UR56Z4N

System Generated Number

  • 0000586378

Structure Descriptors

InChI

InChI=1S/C9H10O2/c1-7(10)8-4-3-5-9(6-8)11-2/h3-6H,1-2H3

InChIKey

BAYUSCHCCGXLAY-UHFFFAOYSA-N

Smiles

COc1cccc(c1)C(=O)C

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point 95.5 deg C   EXP
Boiling Point 240 deg C   EXP
log P (octanol-water) 1.84 (none)   EXP
Water Solubility 2030 mg/L 25 EST
Vapor Pressure 0.080 mm Hg 25 EST
Henry's Law Constant 5.80E-07 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 1.00E-11 cm3/molecule-sec 25 EST

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