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Home > Encyclopedia > 1,2-Benzenediol, 4-(1-heptenyl)- (9CI)

1,2-Benzenediol, 4-(1-heptenyl)- (9CI)

1,2-Benzenediol, 4-(1-heptenyl)- (9CI) structure

1,2-Benzenediol, 4-(1-heptenyl)- (9CI) 

structure
  • CAS No:

    100668-22-2

  • Formula:

    C13H18O2

  • Chemical Name:

    1,2-Benzenediol, 4-(1-heptenyl)- (9CI)

  • Synonyms:

    1,2-benzenediol,4-(1-heptenyl)-;ZINC39096569

1,2-Benzenediol, 4-(1-heptenyl)- (9CI) Basic Attributes

206.28082

206.131

Characteristics

40.5

4.4

1.067±0.06 g/cm3(Predicted)

347.3±30.0 °C(Predicted)

Computed Properties

Molecular Weight:206.28
XLogP3:4.4
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:5
Exact Mass:206.130679813
Monoisotopic Mass:206.130679813
Topological Polar Surface Area:40.5
Heavy Atom Count:15
Complexity:189
Defined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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