Home Halogens N-(5-tert-butyl-1,3,4-thiadiazol-2-yl)-2-chloroacetamide

N-(5-tert-butyl-1,3,4-thiadiazol-2-yl)-2-chloroacetamide

CAS No.:
28242-68-4
Catalog Number:
AG01A0PE
Molecular Formula:
C8H12ClN3OS
Molecular Weight:
233.7184
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Product Description
Catalog Number:
AG01A0PE
Chemical Name:
N-(5-tert-butyl-1,3,4-thiadiazol-2-yl)-2-chloroacetamide
CAS Number:
28242-68-4
Molecular Formula:
C8H12ClN3OS
Molecular Weight:
233.7184
MDL Number:
MFCD00500657
IUPAC Name:
N-(5-tert-butyl-1,3,4-thiadiazol-2-yl)-2-chloroacetamide
InChI:
InChI=1S/C8H12ClN3OS/c1-8(2,3)6-11-12-7(14-6)10-5(13)4-9/h4H2,1-3H3,(H,10,12,13)
InChI Key:
QGFUIOYVGOURCJ-UHFFFAOYSA-N
SMILES:
ClCC(=O)Nc1nnc(s1)C(C)(C)C
Properties
Complexity:
219  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
233.039g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
233.714g/mol
Monoisotopic Mass:
233.039g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
83.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2  
Properties