1320-44-1

Name OCTYLCRESOXYETHOXYETHYL DIMETHYL-BENZYL AMMONIUM CHLORIDE
CAS 1320-44-1
Molecular Formula C28H44NO2.Cl
MDL Number MFCD09951798
MOL File 1320-44-1.mol

Chemical Properties

Melting point  161-163°
Major Application pharmaceutical (small molecule)
InChI 1S/C28H44NO2.ClH/c1-23-20-25(14-15-26(23)28(5,6)22-27(2,3)4)31-19-18-30-17-16-29(7,8)21-24-12-10-9-11-13-24;/h9-15,20H,16-19,21-22H2,1-8H3;1H/q+1;/p-1
InChIKey WYWSKWZUWZLELX-UHFFFAOYSA-M
SMILES [Cl-].[N+](CCOCCOc2cc(c(cc2)C(CC(C)(C)C)(C)C)C)(Cc1ccccc1)(C)C

Safety Data

WGK Germany  WGK 3
Storage Class 8A - Combustible corrosive hazardous materials
Hazard Classifications Acute Tox. 4 Oral
Skin Corr. 1C
Toxicity
LD50 in rats (mg/kg): 100 s.c. (Hart, Huyck)

Hazard Information

Supplier

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