CID 28410304
PubChem CID
28410304
Structure
Molecular Formula
Status
Non-live
Molecular Weight
257.31 g/mol
Dates
- Create:2009-05-28
Chemical Structure Depiction
[amino-[4-(2-phenoxyethoxy)phenyl]methylidene]azanium
InChI=1S/C15H16N2O2/c16-15(17)12-6-8-14(9-7-12)19-11-10-18-13-4-2-1-3-5-13/h1-9H,10-11H2,(H3,16,17)/p+1
GRLAMCATZCAXMT-UHFFFAOYSA-O
C1=CC=C(C=C1)OCCOC2=CC=C(C=C2)C(=[NH2+])N
C15H17N2O2+
Property Name
Property Value
Reference
Property Name
Molecular Weight
Property Value
257.31 g/mol
Property Name
XLogP3
Property Value
2.8
Property Name
Hydrogen Bond Donor Count
Property Value
2
Property Name
Hydrogen Bond Acceptor Count
Property Value
2
Property Name
Rotatable Bond Count
Property Value
6
Property Name
Exact Mass
Property Value
257.129002789 g/mol
Property Name
Monoisotopic Mass
Property Value
257.129002789 g/mol
Property Name
Topological Polar Surface Area
Property Value
70.1 A^2
Property Name
Heavy Atom Count
Property Value
19
Property Name
Formal Charge
Property Value
1
Property Name
Complexity
Property Value
264
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