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