Structure Database (LMSD)

Common Name
2-amino-tetradecanoic acid
Systematic Name
2-amino-tetradecanoic acid
Synonyms
LM ID
LMFA01100007
Status
Active
Exact Mass
Calculate m/z
243.219829
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)
BVXKPGXJOLWHFI-UHFFFAOYSA-N
InChi (Click to copy)
InChI=1S/C14H29NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13(15)14(16)17/h13H,2-12,15H2,1H3,(H,16,17)
SMILES (Click to copy)
C(C(N)CCCCCCCCCCCC)(=O)O

References

Other Databases

LIPIDAT ID
2328
PubChem CID

Calculated Physicochemical Properties

Heavy Atoms 17
Rings 0
Aromatic Rings 0
Rotatable Bonds 12
Van der Waals Molecular Volume 276.70
Topological Polar Surface Area 63.32
Hydrogen Bond Donors 2
Hydrogen Bond Acceptors 2
logP 4.00
Molar Refractivity 72.58

Admin

Created at
-
Updated at
-