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3-HEXYN-1,6-DIOL

3-HEXYN-1,6-DIOL structure

3-HEXYN-1,6-DIOL 

structure
  • CAS No:

    85655-98-7

  • Formula:

    C6H10O2

  • Chemical Name:

    3-HEXYN-1,6-DIOL

  • Synonyms:

    TIMTEC-BB SBB009092;3-HEXYN-1,6-DIOL;3-HEXYNE-1,6-DIOL;3-HEXYN-1,6-DIOL, 97%3-HEXYN-1,6-DIOL, 97%3-HEXYN-1,6-DIOL, 97%;hex-3-yne-1,6-diol;3-HEXYN-1,6-DIOL, 97%,

  • Categories:

    Chemical Reagents  >  Organic Reagents

3-HEXYN-1,6-DIOL Basic Attributes

114.14

114.068079557 g/mol

120452

DTXSID90298070

2905399090

Characteristics

40.46000

-0.24540

1.077±0.06 g/cm3

80-80.5 °C(Solv: benzene (71-43-2))

264.9±15.0 °C(Predicted)

131.8ºC

1.495

14.02±0.10

Computed Properties

Molecular Weight:114.14
XLogP3:-0.2
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:2
Exact Mass:114.068079557
Monoisotopic Mass:114.068079557
Topological Polar Surface Area:40.5
Heavy Atom Count:8
Complexity:85.6
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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