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Dodine Structure

Dodine

  • Product NameDodine
  • CAS2439-10-3
  • MFC13H29N3.C2H4O2
  • MW287.44
  • EINECS219-459-5
  • MOL File2439-10-3.mol

Chemical Properties

Melting point 136°C
Boiling point 429.73°C (rough estimate)
Density  0.9636 (rough estimate)
vapor pressure  5 x 10-6 Pa (20 °C, est.)
refractive index  1.6500 (estimate)
Flash point >100 °C
storage temp.  0-6°C
solubility  DMSO (Slightly, Heated), Methanol (Slightly)
pka >13 (strong base)
Water Solubility  630 mg l-1(25 °C)
Merck  13,3442
BRN  6546960
Henry's Law Constant 1.1×105 mol/(m3Pa) at 25℃, Duchowicz et al. (2020)
Major Application agriculture
environmental
InChI 1S/C13H29N3.C2H4O2/c1-2-3-4-5-6-7-8-9-10-11-12-16-13(14)15;1-2(3)4/h2-12H2,1H3,(H4,14,15,16);1H3,(H,3,4)
InChIKey YIKWKLYQRFRGPM-UHFFFAOYSA-N
SMILES CC(O)=O.CCCCCCCCCCCCNC(N)=N
LogP 1.150
CAS DataBase Reference 2439-10-3(CAS DataBase Reference)
NIST Chemistry Reference 1-dodecylguanidinium acetate(2439-10-3)
EPA Substance Registry System Dodine (2439-10-3)

Safety Information

Hazard Codes  Xn;N,N,Xn
Risk Statements  22-36/38-50/53
Safety Statements  26-60-61
RIDADR  UN 3077
WGK Germany  3
RTECS  MF1750000
TSCA  TSCA listed
HS Code  29252900
Storage Class 11 - Combustible Solids
Hazard Classifications Acute Tox. 4 Oral
Aquatic Acute 1
Aquatic Chronic 1
Eye Irrit. 2
Skin Irrit. 2
Hazardous Substances Data 2439-10-3(Hazardous Substances Data)
Toxicity LC50 in harlequin fish: 0.6 mg/l (Hourdakis)

MSDS

Usage And Synthesis

Preparation Products And Raw materials

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