Decanoic Acid

Decanoic Acid bmse000370 - Data

Decanoic synonyms

Decylic acid; Decanoic acid, lead (2+) salt; Decanoate; NON; n-Capric acid; Lead caprate; DKA; DECANOIC ACID; Versatic 10; tert-DECANOIC ACID; METHYL NONANOATE (ESTER)

Wikipedia:

Graphical representations:

decanoic

View large 3D structure

Molecular Formula: C10H20O2

Natural Isotopic Abundance Mass: 172.2646

Mono-Isotopic Molecular Masses:

  • C12N14: 172.1463298862
  • C13N14: 182.1798782642
  • C12N15: 172.1463298862
  • C13N15: 182.1798782642

InChI string: InChI=1S/C10H20O2/c1-2-3-4-5-6-7-8-9-10(11)12/h2-9H2,1H3,(H,11,12)

PubChem Compound (CID): 2969
CAS Registry number: 334-48-5 15773-52-1 52627-73-3
Sigma-Aldrich: C1875_SIGMA
ChemIDplus: 052627733
ChemSpider: 11212601
MMDB: 34518.3
NMRShiftDB: 10008813
DTP/NCI: 122831
EPA DSSTox: 1554
LipidMAPS: LMFA01010010
SMID: NON
KEGG Compound ID: C01571
ChemDB: 3966259
NCGC: NCGC00091320-02
NIST Chemistry WebBook: 4256317528
MMCD: cq_01025
MDL: MFCD00004441
PDB Compound ID: CRC DKA

Reference data were obtained primarily from the PubChem database.

Three dimensional molecular rendering uses Jmol.

InChI string and atom numbering calculated using ALATIS (Hesam Dashti, William M. Westler, John L. Markley, Hamid R. Eghbalnia, "Unique identifiers for small molecules enable rigorous labeling of their atoms", Scientific Data 4, Article number: 170073 (2017), doi:10.1038/sdata.2017.73, https://www.nature.com/articles/sdata201773)