CID 33819415
PubChem CID
33819415
Structure
Molecular Formula
Status
Non-live
Molecular Weight
285.31 g/mol
Dates
- Create:2009-05-29
Chemical Structure Depiction
2-[4-(4-methoxyphenyl)phenoxy]-2-methylpropanoate
InChI=1S/C17H18O4/c1-17(2,16(18)19)21-15-10-6-13(7-11-15)12-4-8-14(20-3)9-5-12/h4-11H,1-3H3,(H,18,19)/p-1
RSWFYCYTFRXEQB-UHFFFAOYSA-M
CC(C)(C(=O)[O-])OC1=CC=C(C=C1)C2=CC=C(C=C2)OC
C17H17O4-
Property Name
Property Value
Reference
Property Name
Molecular Weight
Property Value
285.31 g/mol
Property Name
XLogP3-AA
Property Value
4.3
Property Name
Hydrogen Bond Donor Count
Property Value
0
Property Name
Hydrogen Bond Acceptor Count
Property Value
4
Property Name
Rotatable Bond Count
Property Value
4
Property Name
Exact Mass
Property Value
285.11268402 g/mol
Property Name
Monoisotopic Mass
Property Value
285.11268402 g/mol
Property Name
Topological Polar Surface Area
Property Value
58.6 A^2
Property Name
Heavy Atom Count
Property Value
21
Property Name
Formal Charge
Property Value
-1
Property Name
Complexity
Property Value
331
Property Name
Isotope Atom Count
Property Value
0
Property Name
Defined Atom Stereocenter Count
Property Value
0
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
CONTENTS