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Home > Encyclopedia > 4-METHYL-2-HEXANOL

4-METHYL-2-HEXANOL

4-METHYL-2-HEXANOL structure

4-METHYL-2-HEXANOL 

structure
  • CAS No:

    2313-61-3

  • Formula:

    C7H16O

  • Chemical Name:

    4-METHYL-2-HEXANOL

  • Synonyms:

    4-Methyl-2-hexanol;4-methylhexan-2-ol;2-Hexanol, 4-methyl-;SCHEMBL92017;DTXSID90880737;AKOS011898638;MCULE-8942040299;FT-0729621;(2R,2S,4S)-(+)-4-METHYL-2-HEXANOL

4-METHYL-2-HEXANOL Basic Attributes

116.20100

116.12000

Characteristics

20.23000

1.80340

0.816g/cm3

-30.45°C (estimate)

152.7ºC at 760mmHg

51.6ºC

1.418

1.28mmHg at 25°C

Computed Properties

Molecular Weight:116.20
XLogP3:2.2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:3
Exact Mass:116.120115130
Monoisotopic Mass:116.120115130
Topological Polar Surface Area:20.2
Heavy Atom Count:8
Complexity:52.3
Undefined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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