CID 52324300
PubChem CID
52324300
Structure
Molecular Formula
Status
Non-live
Molecular Weight
157.21 g/mol
Dates
- Create:2011-05-20
Chemical Structure Depiction
4-ethylpiperidin-1-ium-4-carboxylate
InChI=1S/C8H15NO2/c1-2-8(7(10)11)3-5-9-6-4-8/h9H,2-6H2,1H3,(H,10,11)
KXKKAGIATNDDON-UHFFFAOYSA-N
CCC1(CC[NH2+]CC1)C(=O)[O-]
C8H15NO2
Property Name
Property Value
Reference
Property Name
Molecular Weight
Property Value
157.21 g/mol
Property Name
XLogP3-AA
Property Value
-1.1
Property Name
Hydrogen Bond Donor Count
Property Value
1
Property Name
Hydrogen Bond Acceptor Count
Property Value
2
Property Name
Rotatable Bond Count
Property Value
1
Property Name
Exact Mass
Property Value
157.110278721 g/mol
Property Name
Monoisotopic Mass
Property Value
157.110278721 g/mol
Property Name
Topological Polar Surface Area
Property Value
56.7 A^2
Property Name
Heavy Atom Count
Property Value
11
Property Name
Formal Charge
Property Value
0
Property Name
Complexity
Property Value
145
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
Old substance
CONTENTS