Compound: Tridemorph
SMILES: O1C(CN(CCCCCCCCCCCCC)CC1C)C
InChIKey: YTOPFCCWCSOHFV-UHFFFAOYSA-N
Synonyms: Tridemorph, Calixin, Calixine, 81412-43-3, Tridemorphe, Kalixin, F 220 (fungicide), Tridemorf, BASF 220F, 4-Tridecyl-2,6-dimethylmorpholine, BAS 2203F, N-Tridecyl-2,6-dimethylmorpholin, Elbamorph, Dimethyl-2,6 tridecyl-4 morpholine, 0YZ4Z668EY, RefChem:933375, CALIXIN-86 OL, CHEBI:9700, BAS-2203F, DTXSID60893036, 246-347-3, 24602-86-6, 2,6-DIMETHYL-4-TRIDECYLMORPHOLINE, Kalinin, Morpholine, 2,6-dimethyl-4-tridecyl-, N-Tridecyl-2,6-dimethylmorpholine, Tridemorph [ISO], Tridemorph [BSI:ISO], BAS 2205-F, Tridemorph (Mix of Isomers), NSC 232676, DTXSID3041376, E-236, 2,6-dimethyl-4-tridecyl-morpholine, Morpholine, 2,6-dimethyl-N-tridecyl-, Tridemorph (Technical Grade), Tridemorf [Czech], Caswell No. 386, Tridemorphe [ISO-French], Tridemorph (technical), EINECS 246-347-3, Morpholine,2,6-dimethyl-4-tridecyl-, EPA Pesticide Chemical Code 121401, BRN 0608429, UNII-0YZ4Z668EY, N-Tridecyl-2,6-dimethylmorpholin [German], UNII-784443KX6H, Dimethyl-2,6 tridecyl-4 morpholine [French], Morpholine, 2,6-dimethyl-4-tridecyl-; 2,6-Dimethyl-4-tridecylmorpholine; N-Tridecyl-2,6-dimethylmorpholine; NSC 232676; Tridemorph, SCHEMBL28670, orb1739857, CHEMBL2286765, DTXCID1021376, CHEBI:83365, Morpholine,6-dimethyl-4-tridecyl-, 2,6-dimethyl-n-tridecyl-morpholine, MSK21147, Tox21_300591, BDBM50487253, MFCD00055522, NSC232676, AKOS015914987, 784443KX6H, NSC-232676, NCGC00248097-01, NCGC00254333-01, AC-19786, AS-76727, CAS-24602-86-6, DB-056525, NS00004563, Tridemorph, PESTANAL(R), analytical standard, (2Xi,6Xi)-2,6-dimethyl-4-tridecylmorpholine, G83041, Q209280
Theoretical properties:
molecular_formula: C19H39NO
molecular_weight: 297.5 g/mol
exact_mass: 297.303164868 g/mol
formal_charge: 0
hydrogen_bond_donor_count: 0
hydrogen_bond_acceptor_count: 2
rotatable_bond_count: 12
heavy_atom_count: 21
topological_polar_surface_area: 12.5 Å²
isotope_atom_count: 0
covalently_bonded_unit_count: 1
Physical properties:
melting_point: < 25 °C
Descriptions:
pubchem: 2,6-dimethyl-4-tridecylmorpholine is a member of the class of morpholines that is 2,6-dimethylmorpholine in which the hydrogen attached to the nitrogen is replaced by a tridecyl group. The configuration at positions 2 and 6 is unknown or unspecified. It has a role as an antifungal agrochemical. It is a member of morpholines and a tertiary amino compound.
chebi: A member of the class of morpholines that is 2,6-dimethylmorpholine in which the hydrogen attached to the nitrogen is replaced by a tridecyl group. The configuration at positions 2 and 6 is unknown or unspecified.
chembl: TRIDEMORPH is a small molecule listed in the ChEMBL database but has not progressed to an approved clinical phase.
wikipedia: Tridemorph is a fungicide used to control Erysiphe graminis. It was developed by BASF in the 1960s who use the trade name Calixin. The World Health Organization has categorized it as a Class II "moderately hazardous" pesticide because it is believed harmful if swallowed and can cause irritation to skin and eyes.
One theory for the cause of the Hollinwell incident is that it might have been caused by inhalation of tridemorph.