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98020-38-3 | 2-Aminothiazole-4-carbaldehyde
CAS No: 98020-38-3 Catalog No: AG005WR1 MDL No:MFCD07787389
Product Description
Catalog Number:
AG005WR1
Chemical Name:
2-Aminothiazole-4-carbaldehyde
CAS Number:
98020-38-3
Molecular Formula:
C4H4N2OS
Molecular Weight:
128.1524
MDL Number:
MFCD07787389
IUPAC Name:
2-amino-1,3-thiazole-4-carbaldehyde
InChI:
InChI=1S/C4H4N2OS/c5-4-6-3(1-7)2-8-4/h1-2H,(H2,5,6)
InChI Key:
HFRQSYYNLPNUKI-UHFFFAOYSA-N
SMILES:
Nc1nc(cs1)C=O
Properties
Complexity:
98
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
128.004g/mol
Formal Charge:
0
Heavy Atom Count:
8
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
128.149g/mol
Monoisotopic Mass:
128.004g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
84.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.4
Literature
| Title | Journal |
|---|---|
| Screening of thiourea derivatives and carbonyl-2-aminothiazole derivatives for potential CCR4 antagonists using capillary zone electrophoresis. | Journal of chromatography. B, Analytical technologies in the biomedical and life sciences 20110101 |
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