Pentadecanoic Acid

Pentadecanoic Acid bmse000558 - Data

Pentadecanoic_acid synonyms

n-pentadecanoic acid; n-Pentadecanoic acid; Pentadecanoic acid; Pentadecylic acid; Pentadecyclic acid

Wikipedia:

Graphical representations:

pentadecanoic_acid

View large 3D structure

Molecular Formula: C15H30O2

Natural Isotopic Abundance Mass: 242.3975

Mono-Isotopic Molecular Masses:

  • C12N14: 242.2245802072
  • C13N14: 257.2749027742
  • C12N15: 242.2245802072
  • C13N15: 257.2749027742

InChI string: InChI=1S/C15H30O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15(16)17/h2-14H2,1H3,(H,16,17)

PubChem Compound (CID): 13849
CAS Registry number: 1002-84-2
Sigma-Aldrich: P6125_SIGMA
ChEBI: CHEBI:42504
ChemIDplus: 001002842
ChemSpider: 13885238
MMDB: 31650.9
EINECS: 213-693-1
DTP/NCI: 28486
EPA DSSTox: 21652
LipidMAPS: LMFA01010015
KEGG Compound ID: C16537
Beilstein Handbook Reference: 4-02-00-01147
ChemDB: 3969349
NIST Chemistry WebBook: 3775002218
MMCD: cq_10806
MDL: MFCD00002745
PDB Compound ID: F15

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)