CID 39346414
PubChem CID
39346414
Structure
Molecular Formula
Status
Non-live
Molecular Weight
241.26 g/mol
Dates
- Create:2009-05-29
Chemical Structure Depiction
(2R)-2-(3-phenylphenoxy)propanoate
InChI=1S/C15H14O3/c1-11(15(16)17)18-14-9-5-8-13(10-14)12-6-3-2-4-7-12/h2-11H,1H3,(H,16,17)/p-1/t11-/m1/s1
TYLSLBBNQFQBKW-LLVKDONJSA-M
C[C@H](C(=O)[O-])OC1=CC=CC(=C1)C2=CC=CC=C2
C15H13O3-
Property Name
Property Value
Reference
Property Name
Molecular Weight
Property Value
241.26 g/mol
Property Name
XLogP3
Property Value
4.2
Property Name
Hydrogen Bond Donor Count
Property Value
0
Property Name
Hydrogen Bond Acceptor Count
Property Value
3
Property Name
Rotatable Bond Count
Property Value
3
Property Name
Exact Mass
Property Value
241.086469272 g/mol
Property Name
Monoisotopic Mass
Property Value
241.086469272 g/mol
Property Name
Topological Polar Surface Area
Property Value
49.4 A^2
Property Name
Heavy Atom Count
Property Value
18
Property Name
Formal Charge
Property Value
-1
Property Name
Complexity
Property Value
265
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
CONTENTS