Home Amines 100289-16-5
100289-16-5,MFCD20717113
Catalog No.:AA0001DY
100289-16-5 | Ethanone, 1-(2-amino-4-ethyl-5-thiazolyl)-
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1g
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$936.00   $655.00
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Technical Information
Catalog Number:
AA0001DY
Chemical Name:
Ethanone, 1-(2-amino-4-ethyl-5-thiazolyl)-
CAS Number:
100289-16-5
Molecular Formula:
C7H10N2OS
Molecular Weight:
170.2321
MDL Number:
MFCD20717113
IUPAC Name:
1-(2-amino-4-ethyl-1,3-thiazol-5-yl)ethanone
InChI:
InChI=1S/C7H10N2OS/c1-3-5-6(4(2)10)11-7(8)9-5/h3H2,1-2H3,(H2,8,9)
InChI Key:
XSOPWSQDEZXMFR-UHFFFAOYSA-N
SMILES:
CCc1nc(sc1C(=O)C)N
Properties
Computed Properties
 
Complexity:
163  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
170.051g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
170.23g/mol
Monoisotopic Mass:
170.051g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
84.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5  

Synonyms
 
1-(2-amino-4-ethylthiazol-5-yl)ethanone 
100289-16-5 
1-(2-Amino-4-ethylthiazol-5-yl)ethan-1-one 
MFCD20717113 
AKOS022638157 
CS-0060029 
Ethanone, 1-(2-amino-4-ethyl-5-thiazolyl)- 
Literature
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