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101258-16-6 | Ethanone, 1-(2-amino-4-thiazolyl)-
CAS No: 101258-16-6 Catalog No: AG000436 MDL No:MFCD06090850
Product Description
Catalog Number:
AG000436
Chemical Name:
Ethanone, 1-(2-amino-4-thiazolyl)-
CAS Number:
101258-16-6
Molecular Formula:
C5H6N2OS
Molecular Weight:
142.1789
MDL Number:
MFCD06090850
IUPAC Name:
1-(2-amino-1,3-thiazol-4-yl)ethanone
InChI:
InChI=1S/C5H6N2OS/c1-3(8)4-2-9-5(6)7-4/h2H,1H3,(H2,6,7)
InChI Key:
XLYLXMPLFPQUDL-UHFFFAOYSA-N
SMILES:
CC(=O)c1csc(n1)N
Properties
Complexity:
128
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
142.02g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
142.176g/mol
Monoisotopic Mass:
142.02g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
84.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6
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