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23002-78-0 | Ethanone, 1-(2-methyl-4-thiazolyl)-
CAS No: 23002-78-0 Catalog No: AG002LUG MDL No:MFCD00278580
Product Description
Catalog Number:
AG002LUG
Chemical Name:
Ethanone, 1-(2-methyl-4-thiazolyl)-
CAS Number:
23002-78-0
Molecular Formula:
C6H7NOS
Molecular Weight:
141.1909
MDL Number:
MFCD00278580
IUPAC Name:
1-(2-methyl-1,3-thiazol-4-yl)ethanone
InChI:
InChI=1S/C6H7NOS/c1-4(8)6-3-9-5(2)7-6/h3H,1-2H3
InChI Key:
UJIGIKQKDDJTJL-UHFFFAOYSA-N
SMILES:
Cc1scc(n1)C(=O)C
Properties
Complexity:
126
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
141.025g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
141.188g/mol
Monoisotopic Mass:
141.025g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
58.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4
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