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Home > Encyclopedia > Methyl 3-hydroxyoctanoate

Methyl 3-hydroxyoctanoate

Methyl 3-hydroxyoctanoate structure

Methyl 3-hydroxyoctanoate 

structure
  • CAS No:

    7367-87-5

  • Formula:

    C9H18O3

  • Chemical Name:

    Methyl 3-hydroxyoctanoate

  • Synonyms:

    Octanoic acid,3-hydroxy-,methyl ester;β-Hydroxyoctanoic acid methyl ester;Methyl 3-hydroxycaprylate;Methyl 3-hydroxyoctanoate;3-Hydroxyoctanoic acid methyl ester;85549-54-8

Methyl 3-hydroxyoctanoate Basic Attributes

174.24

174.24

2309173

DTXSID70276098

Characteristics

46.5 Ų

0.976±0.06 g/cm3

110-112 °C @ Press: 9 Torr

14.09±0.20

Methyl 3-hydroxyoctanoate Use and Manufacturing

3-Hydroxyoctanoic Acid Methyl Ester is a volatile ester found in fruit juices used as a flavoring compound.

Computed Properties

Molecular Weight:174.24
XLogP3:1.8
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:7
Exact Mass:174.125594432
Monoisotopic Mass:174.125594432
Topological Polar Surface Area:46.5
Heavy Atom Count:12
Complexity:123
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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