DECYLTRIMETHYLPHOSPHONIUM CHLORIDE

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Molecule Category Salt-form
Source Gaulton A, Kale N, van Westen GJ, Bellis LJ, Bento AP, Davies M, Hersey A, Papadatos G, Forster M, Wege P, Overington JP. A large-scale crop protection bioassay data set. Sci Data. 2015 Jul 7;2:150032. Read more ...

Structure

InChI Key GAMJBUWBZFGZEA-UHFFFAOYSA-M
Smiles [Cl-].CCCCCCCCCC[P+](C)(C)C
InChI
InChI=1S/C13H30P.ClH/c1-5-6-7-8-9-10-11-12-13-14(2,3)4;/h5-13H2,1-4H3;1H/q+1;/p-1

Physicochemical Descriptors

Property Name Value
Molecular Formula C13H30ClP
Molecular Weight 252.8
AlogP 4.48
Number of Rotational Bond 9.0
Heavy Atoms 14.0

Cross References

Resources Reference
ChEMBL CHEMBL2253492
PubChem 76315520
SureChEMBL SCHEMBL516255
CONTENTS