Structure Database (LMSD)

Common Name
3R-aminononanoic acid
Systematic Name
3R-aminononanoic acid
Synonyms
  • Nonanoic acid, 3-amino-, (R)-
LM ID
LMFA01100019
Status
Active
Exact Mass
Calculate m/z
173.141579
Formula


Download as...
MDLMOL SDF CSV TSV
MDLMOL files can be opened in various drawing programs. In ChemDraw, open as filetype "MDL Molfile".

Main

Classification

String Representations

InChiKey (Click to copy)
JSJXIPXCQNHXJA-MRVPVSSYSA-N
InChi (Click to copy)
InChI=1S/C9H19NO2/c1-2-3-4-5-6-8(10)7-9(11)12/h8H,2-7,10H2,1H3,(H,11,12)/t8-/m1/s1
SMILES (Click to copy)
C(C[C@H](N)CCCCCC)(=O)O

References

Other Databases

LIPIDAT ID
2309
PubChem CID

Calculated Physicochemical Properties

Heavy Atoms 12
Rings 0
Aromatic Rings 0
Rotatable Bonds 7
Van der Waals Molecular Volume 190.20
Topological Polar Surface Area 63.32
Hydrogen Bond Donors 2
Hydrogen Bond Acceptors 2
logP 2.05
Molar Refractivity 49.50

Admin

Created at
-
Updated at
-