4-Methyl-2-thioxo-2,3-dihydrothiazole-5-carboxylic acid

Name: 4-Methyl-2-thioxo-2,3-dihydrothiazole-5-carboxylic acid
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CAS No. 57658-34-1
Cat. No. CS-0580658
Molecule weight175.23
Purity≥98%
MDL No.None

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Type	HazMat Fee
Excepted Quantity	$0.00
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Accessible (Haz class 3, 4, 5 or 8), Domestic	$158.00+
Inaccessible (Haz class 6.1 or 9), International	$108.00+
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4-Methyl-2-thioxo-2,3-dihydrothiazole-5-carboxylic acid|CS-0580658

Structure of 57658-34-1

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General Information

CAS No. 57658-34-1
Cat. No. CS-0580658
Purity ≥98%
MDL No. None
Storage Sealed in dry,2-8℃
Shipping Room temperature in continental US; may vary elsewhere.
Molecular Formula C₅H₅NO₂S₂
Molecular Weight 175.23
Synonym(s) 2-mercapto-4-methyl-5-Thiazolecarboxylic acid
SMILES CC1=C(SC(=S)N1)C(=O)O

Synthesis

Route1
- 17309-13-6
- ~%
- 57658-34-1
References
- Miolati Gazzetta Chimica Italiana, 1893 , vol. 23 I, p. 578
Route2
- 76816-22-3
- ~%
- 57658-34-1
References
- D'Amico Journal of the American Chemical Society, 1953 , vol. 75, p. 102

Safety Information

Download SDS

GHS Pictogram : N/A	GHS No : N/A
Signal Word : N/A	UN#: N/A
Class : N/A	Packing Group : N/A
Hazard Statements : N/A
Precautionary Statements : N/A

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Computational Chemistry Data

TPSA 53.09
LogP 1.81231
H_Acceptors 3
H_Donors 2
Rotatable_Bonds 1

Other Classifications

Building Blocks Skeleton Aromatic heterocycle compounds Thiazole compounds

Key Words

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4-Methyl-2-thioxo-2,3-dihydrothiazole-5-carboxylic acid

CAS No. 57658-34-1

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General Information

Synthesis

References