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57738-11-1 | 1-(6-METHYLIMIDAZO[2,1-B][1,3]THIAZOL-5-YL)ETHANONE
CAS No: 57738-11-1 Catalog No: AG00EIWI MDL No:MFCD00775054
Product Description
Catalog Number:
AG00EIWI
Chemical Name:
1-(6-METHYLIMIDAZO[2,1-B][1,3]THIAZOL-5-YL)ETHANONE
CAS Number:
57738-11-1
Molecular Formula:
C8H8N2OS
Molecular Weight:
180.2269
MDL Number:
MFCD00775054
IUPAC Name:
1-(6-methylimidazo[2,1-b][1,3]thiazol-5-yl)ethanone
InChI:
InChI=1S/C8H8N2OS/c1-5-7(6(2)11)10-3-4-12-8(10)9-5/h3-4H,1-2H3
InChI Key:
UOGOENQNMWUIRE-UHFFFAOYSA-N
SMILES:
CC(=O)c1c(C)nc2n1ccs2
Properties
Complexity:
209
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
180.036g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
180.225g/mol
Monoisotopic Mass:
180.036g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
62.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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