1-Heptadec-1-ynyl-cyclohexanol

1-Heptadec-1-ynyl-cyclohexanol
Compound Structure:
Synonyms: 1-Heptadec-1-ynyl-cyclohexanol;1-(1-Heptadecynyl)cyclohexanol ;AKOS037626238
Compound ID: NMPC-078
PubChem ID:

536341
Molecular Formula: C23H42O
Canonical SMILES: CCCCCCCCCCCCCCCC#CC1(CCCCC1)O
InChIKey: GAXZWHKFUYWQNZ-UHFFFAOYSA-N
About the compound:
Properties:

Chemical and Physical Properties

Property Name

Property Value

Molecular Weight

334.6 g/mol

XLogP3-AA

9.2

Hydrogen Bond Donor Count

1

Hydrogen Bond Acceptor Count

1

Rotatable Bond Count

14

Exact Mass

334.323565959 g/mol

Monoisotopic Mass

334.323565959 g/mol

Topological Polar Surface Area

20.2Ų

Heavy Atom Count

24

Formal Charge

0

Complexity

340

Isotope Atom Count

0

Defined Atom Stereocenter Count

0

Undefined Atom Stereocenter Count

0

Defined Bond Stereocenter Count

0

Undefined Bond Stereocenter Count

0

Covalently-Bonded Unit Count

1

Compound Is Canonicalized

Yes

Source: PubChem

                                                         
Source Species: Terminalia superba
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