Home Other Building Blocks 2-CHLORO-1-(4-METHYL-1,2,3-THIADIAZOL-5-YL)ETHAN-1-ONE

2-CHLORO-1-(4-METHYL-1,2,3-THIADIAZOL-5-YL)ETHAN-1-ONE

CAS No.:
1504719-85-0
Catalog Number:
AG01DVFL
Molecular Formula:
C5H5ClN2OS
Molecular Weight:
176.6240
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Product Description
Catalog Number:
AG01DVFL
Chemical Name:
2-CHLORO-1-(4-METHYL-1,2,3-THIADIAZOL-5-YL)ETHAN-1-ONE
CAS Number:
1504719-85-0
Molecular Formula:
C5H5ClN2OS
Molecular Weight:
176.6240
MDL Number:
MFCD23844987
IUPAC Name:
2-chloro-1-(4-methylthiadiazol-5-yl)ethanone
InChI:
InChI=1S/C5H5ClN2OS/c1-3-5(4(9)2-6)10-8-7-3/h2H2,1H3
InChI Key:
BCDCLNYWHZFUHP-UHFFFAOYSA-N
SMILES:
ClCC(=O)c1snnc1C
Properties
Complexity:
144  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
175.981g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
176.618g/mol
Monoisotopic Mass:
175.981g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
71.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5  
Properties