CID 35794905
PubChem CID
35794905
Structure
Molecular Formula
Status
Non-live
Molecular Weight
225.24 g/mol
Dates
- Create:2009-05-29
Chemical Structure Depiction
(2S)-2-pyridin-3-yl-2,3-dihydrochromen-4-one
InChI=1S/C14H11NO2/c16-12-8-14(10-4-3-7-15-9-10)17-13-6-2-1-5-11(12)13/h1-7,9,14H,8H2/t14-/m0/s1
MTWWWZCZZFGTEO-AWEZNQCLSA-N
C1[C@H](OC2=CC=CC=C2C1=O)C3=CN=CC=C3
C14H11NO2
Property Name
Property Value
Reference
Property Name
Molecular Weight
Property Value
225.24 g/mol
Property Name
XLogP3-AA
Property Value
1.8
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
1
Property Name
Exact Mass
Property Value
225.078978594 g/mol
Property Name
Monoisotopic Mass
Property Value
225.078978594 g/mol
Property Name
Topological Polar Surface Area
Property Value
39.2 A^2
Property Name
Heavy Atom Count
Property Value
17
Property Name
Formal Charge
Property Value
0
Property Name
Complexity
Property Value
292
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