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DULCIN Structure

DULCIN

Chemical Properties

Melting point 160-161℃
Boiling point 313.03°C (rough estimate)
Density  1.199
refractive index  1.5373 (estimate)
storage temp.  Sealed in dry,2-8°C
solubility  DMSO (Slightly), Methanol (Slightly)
form  Solid
color  White to Off-White
Water Solubility  1.21g/L(21 ºC)
λmax 289nm(EtOH)(lit.)
Merck  14,3464
Henry's Law Constant 6.2×105 mol/(m3Pa) at 25℃, HSDB (2015)
InChI 1S/C9H12N2O2/c1-2-13-8-5-3-7(4-6-8)11-9(10)12/h3-6H,2H2,1H3,(H3,10,11,12)
InChIKey GGLIEWRLXDLBBF-UHFFFAOYSA-N
SMILES NC(NC1=CC=C(OCC)C=C1)=O
LogP 1.005 (est)
CAS DataBase Reference 150-69-6
IARC 3 (Vol. 12, Sup 7) 1987
EPA Substance Registry System Dulcin (150-69-6)

Safety Information

Hazard Codes  Xi
WGK Germany  WGK 3
RTECS  YT2275000
Hazard Note  Irritant
HS Code  2924190090
Storage Class 11 - Combustible Solids
Hazard Classifications Acute Tox. 4 Oral
Hazardous Substances Data 150-69-6(Hazardous Substances Data)

Usage And Synthesis

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