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Substance Name: 3-Methoxybutanol
RN: 2517-43-3
UNII: SJ995B41AO
InChIKey: JSGVZVOGOQILFM-UHFFFAOYSA-N

Molecular Formula

  • C5-H12-O2

Molecular Weight

  • 104.148
 
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Names and Synonyms

Name of Substance

  • 3-Methoxybutanol

Synonyms

  • 3-Methoxy-1-butanol
  • 3-Methoxybutanol
  • AI3-24920
  • CCRIS 8976
  • EC 219-741-8
  • EINECS 219-741-8
  • NSC 65580
  • UNII-SJ995B41AO

Systematic Names

  • 1-Butanol, 3-methoxy-
  • 3-Methoxybutan-1-ol

Superlist Name

  • 3-Methoxy-1-butanol

Registry Numbers

CAS Registry Number

  • 2517-43-3

FDA UNII

  • SJ995B41AO

Other Registry Number

  • 89378-53-0

System Generated Number

  • 0002517433

Structure Descriptors

InChI

1S/C5H12O2/c1-5(7-2)3-4-6/h5-6H,3-4H2,1-2H3

InChIKey

JSGVZVOGOQILFM-UHFFFAOYSA-N

Smiles

C([C@@H](OC)C)CO

Physical Properties

Physical Property Value Units Temp (deg C) Source
Boiling Point 157 deg C   EXP
log P (octanol-water) .00E+00 (none)   EST
Water Solubility 3.66E+05 mg/L 25 EST
Vapor Pressure 1.620 mm Hg 25 EST
Henry's Law Constant 7.38E-08 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 2.36E-11 cm3/molecule-sec 25 EXP

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