CID 39378807
PubChem CID
39378807
Structure
Molecular Formula
Status
Non-live
Molecular Weight
278.4 g/mol
Dates
- Create:2009-05-29
Chemical Structure Depiction
(1R)-1-cyclohexyl-3-(4-ethoxyphenoxy)propan-1-ol
InChI=1S/C17H26O3/c1-2-19-15-8-10-16(11-9-15)20-13-12-17(18)14-6-4-3-5-7-14/h8-11,14,17-18H,2-7,12-13H2,1H3/t17-/m1/s1
URLDFSWSLNRLOJ-QGZVFWFLSA-N
CCOC1=CC=C(C=C1)OCC[C@H](C2CCCCC2)O
C17H26O3
Property Name
Property Value
Reference
Property Name
Molecular Weight
Property Value
278.4 g/mol
Property Name
XLogP3-AA
Property Value
4.3
Property Name
Hydrogen Bond Donor Count
Property Value
1
Property Name
Hydrogen Bond Acceptor Count
Property Value
3
Property Name
Rotatable Bond Count
Property Value
7
Property Name
Exact Mass
Property Value
278.18819469 g/mol
Property Name
Monoisotopic Mass
Property Value
278.18819469 g/mol
Property Name
Topological Polar Surface Area
Property Value
38.7 A^2
Property Name
Heavy Atom Count
Property Value
20
Property Name
Formal Charge
Property Value
0
Property Name
Complexity
Property Value
243
Property Name
Isotope Atom Count
Property Value
0
Property Name
Defined Atom Stereocenter Count
Property Value
1
Property Name
Undefined Atom Stereocenter Count
Property Value
0
Property Name
Defined Bond Stereocenter Count
Property Value
0
Property Name
Undefined Bond Stereocenter Count
Property Value
0
Property Name
Covalently-Bonded Unit Count
Property Value
1
Property Name
Compound Is Canonicalized
Property Value
Yes
Old substance
Old substance
CONTENTS