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Home > Encyclopedia > 3-(1-adamantyl)-2-propynoic acid

3-(1-adamantyl)-2-propynoic acid

3-(1-adamantyl)-2-propynoic acid structure

3-(1-adamantyl)-2-propynoic acid 

structure
  • CAS No:

    106386-45-2

  • Formula:

    C13H16O2

  • Chemical Name:

    3-(1-adamantyl)-2-propynoic acid

  • Synonyms:

    3-(1-adamantyl)-2-propynoic acid;3-(ADAMANTAN-1-YL)PROP-2-YNOIC ACID;106386-45-2;3-(1-adamantyl)prop-2-ynoic acid;Oprea1_682653;3-adamantanylprop-2-ynoic acid;ZINC52494;STK675123;AKOS001740497;MCULE-1104839851

3-(1-adamantyl)-2-propynoic acid Basic Attributes

204.26494

204.115

Characteristics

37.3

3.8

130 - 131 °C (petroleum ether)

Computed Properties

Molecular Weight:204.26
XLogP3:3.8
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:1
Exact Mass:204.115029749
Monoisotopic Mass:204.115029749
Topological Polar Surface Area:37.3
Heavy Atom Count:15
Complexity:327
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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