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Home > Other Heterocycles > 89027-56-5

89027-56-5

89027-56-5 | Phenol, 4-(4-propylbicyclo[2.2.2]oct-1-yl)-

CAS No: 89027-56-5 Catalog No: AG0044BL MDL No:

Product Description

Catalog Number:
AG0044BL
Chemical Name:
Phenol, 4-(4-propylbicyclo[2.2.2]oct-1-yl)-
CAS Number:
89027-56-5
Molecular Formula:
C17H24O
Molecular Weight:
244.3719
IUPAC Name:
4-(4-propyl-1-bicyclo[2.2.2]octanyl)phenol
InChI:
InChI=1S/C17H24O/c1-2-7-16-8-11-17(12-9-16,13-10-16)14-3-5-15(18)6-4-14/h3-6,18H,2,7-13H2,1H3
InChI Key:
MUCPZZXRRXIUAY-UHFFFAOYSA-N
SMILES:
CCCC12CCC(CC1)(CC2)c1ccc(cc1)O

Properties

Complexity:
264  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
244.183g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
244.378g/mol
Monoisotopic Mass:
244.183g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
6.2  

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