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About This Item
Empirical Formula (Hill Notation):
C4H5NS
CAS Number:
Molecular Weight:
99.15
Beilstein:
104674
MDL number:
UNSPSC Code:
12352100
PubChem Substance ID:
NACRES:
NA.22
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Quality Level
Assay
97%
form
liquid
refractive index
n20/D 1.528 (lit.)
bp
141-142 °C/745 mmHg (lit.)
density
1.12 g/mL at 25 °C (lit.)
SMILES string
Cc1cncs1
InChI
1S/C4H5NS/c1-4-2-5-3-6-4/h2-3H,1H3
InChI key
RLYUNPNLXMSXAX-UHFFFAOYSA-N
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General description
The microwave spectrum of 5-methylthiazole was investigated by employing both Fourier transform and Stark spectroscopy. 5-methyl thiazole undergoes alkylation with n-butyl bromide followed by anion exchange of Br- for BF4- to give mobile, room-temperature ionic liquids.
Signal Word
Warning
Hazard Statements
Precautionary Statements
Hazard Classifications
Eye Irrit. 2 - Flam. Liq. 3 - Skin Irrit. 2 - STOT SE 3
Target Organs
Respiratory system
Storage Class Code
3 - Flammable liquids
WGK
WGK 3
Flash Point(F)
107.6 °F - closed cup
Flash Point(C)
42 °C - closed cup
Personal Protective Equipment
dust mask type N95 (US), Eyeshields, Gloves
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The microwave spectrum of 5-methylthiazole: methyl internal rotation,< sup> 14</sup> N nuclear quadrupole coupling and electric dipole moment.
Jager W and M Hader.
Journal of Molecular Structure, 190, 295-305 (1998)
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Tetrahedron Letters, 40(9), 1621-1622 (1999)
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