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Substance Name: 4-Chloroanisole
RN: 623-12-1
UNII: 0F18BLY08Q
InChIKey: YRGAYAGBVIXNAQ-UHFFFAOYSA-N

Molecular Formula

  • C7-H7-Cl-O

Molecular Weight

  • 142.584
 
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Names and Synonyms

Name of Substance

  • 4-Chloroanisole

Synonyms

  • 1-Chloro-4-methoxybenzene
  • 4-Chloroanisole
  • 4-Chlorophenol methyl ether
  • 4-Monochloroanisole
  • AI3-07211
  • Anisyl chloride
  • EINECS 210-772-2
  • NSC 4129
  • p-Chloroanisole
  • p-Chloromethoxybenzene
  • p-Chlorophenyl methyl ether
  • UNII-0F18BLY08Q

Systematic Names

  • 4-Chloroanisole
  • Anisole, p-chloro- (8CI)
  • Benzene, 1-chloro-4-methoxy-

Registry Numbers

CAS Registry Number

  • 623-12-1

FDA UNII

  • 0F18BLY08Q

System Generated Number

  • 0000623121

Structure Descriptors

InChI

1S/C7H7ClO/c1-9-7-4-2-6(8)3-5-7/h2-5H,1H3

InChIKey

YRGAYAGBVIXNAQ-UHFFFAOYSA-N

Smiles

c1(ccc(Cl)cc1)OC

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point -1.80E+01 deg C   EXP
Boiling Point 197.5 deg C   EXP
log P (octanol-water) 2.78 (none)   EXP
Water Solubility 237 mg/L 25 EXP
Vapor Pressure 0.811 mm Hg 25 EST
Henry's Law Constant 2.36E-04 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 7.11E-12 cm3/molecule-sec 25 EST

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