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Cetylpyridinium chloride monohydrate Structure

Cetylpyridinium chloride monohydrate

Chemical Properties

Melting point 81-84 °C
bulk density 370kg/m3
storage temp.  Store below +30°C.
solubility  H2O: soluble0.5M, clear, colorless to faintly yellow
form  Powder
color  White
PH 5.0-5.4 (10g/l, H2O, 20℃)
Water Solubility  Soluble in water, alcohol, chloroform
Merck  14,2032
BRN  3578606
Stability Stable. Combustible. Incompatible with strong oxidizing agents, acids, acid anhydrides, acid chlorides.
Cosmetics Ingredients Functions DEODORANT
ANTIMICROBIAL
ORAL CARE
ANTISTATIC
InChI InChI=1S/C21H38N.ClH.H2O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-16-19-22-20-17-15-18-21-22;;/h15,17-18,20-21H,2-14,16,19H2,1H3;1H;1H2/q+1;;/p-1
InChIKey NFCRBQADEGXVDL-UHFFFAOYSA-M
SMILES C1=[N+](CCCCCCCCCCCCCCCC)C=CC=C1.[Cl-].[H]O[H]
LogP 1.699 (est)
CAS DataBase Reference 6004-24-6(CAS DataBase Reference)

Safety Information

Hazard Codes  T+,N,Xi
Risk Statements  25-26-38-50/53-36/37/38
Safety Statements  28-36/37-45-7/9-61-26-36
RIDADR  UN 2811 6.1/PG 1
WGK Germany  3
RTECS  UU5075000
TSCA  Yes
HazardClass  6.1
PackingGroup  I
HS Code  29333999
Storage Class 6.1A - Combustible acute toxic Cat. 1 and 2
very toxic hazardous materials
Hazard Classifications Acute Tox. 2 Inhalation
Acute Tox. 4 Oral
Aquatic Acute 1
Eye Dam. 1
Skin Irrit. 2
STOT SE 3
Toxicity LD50 in rats (mg/kg): 250 s.c.; 6 i.p.; 30 i.v.; 200 orally (Nelson, Lyster)

MSDS

Usage And Synthesis

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