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(1-Propyldecyl)cyclohexane

PubChem CID: 524438

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Compound Synonyms (1-Propyldecyl)cyclohexane, tridecan-4-ylcyclohexane, Tridecane, 4-cyclohexyl-, 13151-89-8, Cyclohexane, 1-propyldecyl, (1-Propyldecyl)cyclohexane #, IUKSHHIAVABBGM-UHFFFAOYSA-N
Topological Polar Surface Area 0.0
Hydrogen Bond Donor Count 0.0
Heavy Atom Count 19.0
Isotope Atom Count 0.0
Molecular Complexity 178.0
Database Name cmaup_ingredients;pubchem
Defined Atom Stereocenter Count 0.0
Iupac Name tridecan-4-ylcyclohexane
Prediction Hob 1.0
Xlogp 9.7
Molecular Formula C19H38
Prediction Swissadme 0.0
Inchi Key IUKSHHIAVABBGM-UHFFFAOYSA-N
Fcsp3 1.0
Logs -7.233
Rotatable Bond Count 11.0
Logd 5.266
Compound Name (1-Propyldecyl)cyclohexane
Prediction Hob Swissadme 0.0
Exact Mass 266.297
Formal Charge 0.0
Monoisotopic Mass 266.297
Hydrogen Bond Acceptor Count 0.0
Molecular Weight 266.5
Covalent Unit Count 1.0
Total Atom Stereocenter Count 1.0
Total Bond Stereocenter Count 0.0
Esol -6.8836806
Inchi InChI=1S/C19H38/c1-3-5-6-7-8-9-11-15-18(14-4-2)19-16-12-10-13-17-19/h18-19H,3-17H2,1-2H3
Smiles CCCCCCCCCC(CCC)C1CCCCC1
Nring 1.0
Defined Bond Stereocenter Count 0.0

  • 1. Outgoing r'ship FOUND_IN to/from Citrullus Lanatus (Plant) Rel Props:Source_db:cmaup_ingredients