4-(Trans-4-propylcyclohexyl) phenylacetylene - CAS 81936-33-6
Catalog: |
BB053700 |
Product Name: |
4-(Trans-4-propylcyclohexyl) phenylacetylene |
CAS: |
81936-33-6 |
Synonyms: |
P-(TRANS-4-PROPYLCYCLOHEXYL)PHENOL; 4-(TRANS-4-N-PROPYLCYCLOHEXYL)PHENOL; 4-Trans-(4-propylcyclohexyl) Phenol; 4-(Trans-4-propylcyclohexyl) phenylacetylene; 4-(Trans-4-N-Propylcyclohexyl)Phenol,3PcoC15H22O; trans-4-Propyl Cyclohexyl Phenol; Phenol, 4-(trans-4- |
IUPAC Name: | 4-(4-propylcyclohexyl)phenol |
Molecular Weight: | 218.33 |
Molecular Formula: | C15H22O |
Canonical SMILES: | CCCC1CCC(CC1)C2=CC=C(C=C2)O |
InChI: | InChI=1S/C15H22O/c1-2-3-12-4-6-13(7-5-12)14-8-10-15(16)11-9-14/h8-13,16H,2-7H2,1H3/t12-,13- |
InChI Key: | AHAZEMSUUYFDMM-JOCQHMNTSA-N |
Boiling Point: | 339.8±21.0 °C at 760 mmHg |
Purity: | >98% by GC |
Density: | 1.0±0.1 g/cm3 |
Appearance: | White to Pale Yellow Powder |
Complexity: | 186 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 218.167065321 |
Formal Charge: | 0 |
Heavy Atom Count: | 16 |
Hydrogen Bond Acceptor Count: | 1 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 218.167065321 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 20.2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 5.6 |
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