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Substance Name: 4,5-Dimethylthiazole
RN: 3581-91-7
UNII: U3RP5I088G
InChIKey: UWSONZCNXUSTKW-UHFFFAOYSA-N

Molecular Formula

  • C5-H7-N-S

Molecular Weight

  • 113.1833
 
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Names and Synonyms

Results Name

  • 4,5-Dimethylthiazole

Name of Substance

  • 4,5-Dimethylthiazole

Synonyms

  • 4,5-Dimethylthiazole
  • 4-27-00-00986 (Beilstein Handbook Reference)
  • BRN 0105694
  • EINECS 222-703-3
  • FEMA No. 3274
  • Thiazole, 4,5-dimethyl-
  • UNII-U3RP5I088G

Systematic Names

  • 4,5-Dimethylthiazole
  • Thiazole, 4,5-dimethyl-

Superlist Name

  • 4,5-Dimethylthiazole

Registry Numbers

CAS Registry Number

  • 3581-91-7

FDA UNII

  • U3RP5I088G

System Generated Number

  • 0003581917

Structure Descriptors

InChI

1S/C5H7NS/c1-4-5(2)7-3-6-4/h3H,1-2H3

InChIKey

UWSONZCNXUSTKW-UHFFFAOYSA-N

Smiles

c1(c(scn1)C)C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rat LD50 oral 960mg/kg (960mg/kg) SENSE ORGANS AND SPECIAL SENSES: CHROMODACYRORREA: EYE

LUNGS, THORAX, OR RESPIRATION: DYSPNEA
Acute Toxicity Data. Journal of the American College of Toxicology, Part B. Vol. 1, Pg. 95, 1990.

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point 83.5 deg C   EXP
Boiling Point 158 deg C   EXP
log P (octanol-water) 2.090 (none)   EST
Atmospheric OH Rate Constant 2.38E-12 cm3/molecule-sec 25 EST

Physical property data is provided to ChemIDplus by SRC, Inc.