Product Name

  • Name

    4,5-Dimethyl-2-isobutyl-3-thiazoline

  • EINECS 265-969-6
  • CAS No. 65894-83-9
  • Density 1.04 g/cm3
  • Solubility
  • Melting Point
  • Formula C9H17NS
  • Boiling Point 233.5 °C at 760 mmHg
  • Molecular Weight 171.307
  • Flash Point 95 °C
  • Transport Information
  • Appearance Light yellow liquid.
  • Safety
  • Risk Codes
  • Molecular Structure Molecular Structure of 65894-83-9 (4,5-Dimethyl-2-isobutyl-3-thiazoline)
  • Hazard Symbols
  • Synonyms 2-(2'-Methyl-n-propyl)-4,5-dimethyl-D3-thiazoline;Thiazole,2,5-dihydro-4,5-dimethyl-2-(2-methylpropyl)-;
  • PSA 37.66000
  • LogP 2.39040

4,5-Dimethyl-2-isobutyl-3-thiazoline Chemical Properties

Molecular Structure of 4,5-Dimethyl-2-isobutyl-3-thiazoline (CAS NO.65894-83-9):

IUPAC Name: 4,5-Dimethyl-2-(2-methylpropyl)-2,5-dihydro-1,3-thiazole
Canonical SMILES: CC1C(=NC(S1)CC(C)C)C
InChI: InChI=1S/C9H17NS/c1-6(2)5-9-10-7(3)8(4)11-9/h6,8-9H,5H2,1-4H3
InChIKey: FDOISHJOXPONIV-UHFFFAOYSA-N
Molecular Weight: 171.30298 [g/mol]
Molecular Formula: C9H17NS
XLogP3-AA: 2.6
H-Bond Donor: 0
H-Bond Acceptor: 1
FEMA: 3621 
EINECS: 265-969-6
Appearance: Light yellow liquid.
Index of Refraction: 1.539
Molar Refractivity: 51.59 cm3
Molar Volume: 164.5 cm3
Surface Tension: 30.3 dyne/cm
Density: 1.04 g/cm3
Flash Point: 95 °C
Enthalpy of Vaporization: 45.11 kJ/mol
Boiling Point: 233.5 °C at 760 mmHg
Vapour Pressure: 0.0848 mmHg at 25 °C
Product Categories: thiazole Flavor; Building Blocks; Heterocyclic Building Blocks; Thiazolines / Thiazolidines

4,5-Dimethyl-2-isobutyl-3-thiazoline Uses

  4,5-Dimethyl-2-isobutyl-3-thiazoline (CAS NO.65894-83-9) is commonly used as organic reagent.

4,5-Dimethyl-2-isobutyl-3-thiazoline Toxicity Data With Reference

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 3067mg/kg (3067mg/kg)   Drug and Chemical Toxicology. Vol. 3, Pg. 249, 1980.
 

4,5-Dimethyl-2-isobutyl-3-thiazoline Safety Profile

Safety Information of 4,5-Dimethyl-2-isobutyl-3-thiazoline (CAS NO.65894-83-9):
WGK Germany: 2
RTECS: XJ6642800

4,5-Dimethyl-2-isobutyl-3-thiazoline Specification

 4,5-Dimethyl-2-isobutyl-3-thiazoline (CAS NO.65894-83-9), its Synonyms are Thiazole, 2,5-dihydro-4,5-dimethyl-2-(2-methylpropyl)- ; 2,5-Dihydro-4,5-dimethyl-2-(2-methylpropyl)thiazole ; 2-Isobutyl-4,5-dimethyl thiazoline ; 3-Thiazoline, 4,5-dimethyl-2-isobutyl- .

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