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Home > Encyclopedia > 2,4-Pentanediol, 1-(3-furanyl)-

2,4-Pentanediol, 1-(3-furanyl)-

2,4-Pentanediol, 1-(3-furanyl)- structure

2,4-Pentanediol, 1-(3-furanyl)- 

structure
  • CAS No:

    53011-73-7

  • Formula:

    C9H14O3

  • Chemical Name:

    2,4-Pentanediol, 1-(3-furanyl)-

  • Synonyms:

    2,4-Pentanediol,1-(3-furanyl)-;1,4-Ipomeadiol;1-(Furan-3-yl)pentane-2,4-diol

2,4-Pentanediol, 1-(3-furanyl)- Basic Attributes

170.20600

170.21

Characteristics

53.60000

0.95390

1.132g/cm3

311.8ºC at 760mmHg

142.4ºC

1.51

Drug Information

1,4-ipomeadiol

Computed Properties

Molecular Weight:170.21
XLogP3:0.7
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:4
Exact Mass:170.094294304
Monoisotopic Mass:170.094294304
Topological Polar Surface Area:53.6
Heavy Atom Count:12
Complexity:127
Undefined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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