Structure Database (LMSD)
Common Name
Caproic acid
Systematic Name
Hexanoic acid
Synonyms
- Capronic acid
- C6:0
- Butylacetic acid
- Pentylformic acid
Main
Classification
Category
Main Class
Sub Class
String Representations
InChiKey (Click to copy)
FUZZWVXGSFPDMH-UHFFFAOYSA-N
InChi (Click to copy)
InChI=1S/C6H12O2/c1-2-3-4-5-6(7)8/h2-5H2,1H3,(H,7,8)
SMILES (Click to copy)
CCCCCC(=O)O
References
Other Databases
Wikipedia
KEGG ID
HMDB ID
CHEBI ID
LIPIDBANK ID
DFA0006
PubChem CID
PlantFA ID
SwissLipids ID
Calculated Physicochemical Properties
Heavy Atoms
8
Rings
0
Aromatic Rings
0
Rotatable Bonds
4
Van der Waals Molecular Volume
127.30
Topological Polar Surface Area
37.30
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
2
logP
1.65
Molar Refractivity
31.78
Reactions
Click on an edge to display the reaction(s).

Genes - taxonomic species to visualise:
Admin
Created at
-
Updated at
25th Apr 2022