Home Halogens 4-[(3-tert-butyl-1,2,4-thiadiazol-5-yl)oxy]-3-chloroaniline

4-[(3-tert-butyl-1,2,4-thiadiazol-5-yl)oxy]-3-chloroaniline

CAS No.:
1482722-68-8
Catalog Number:
AG01AG58
Molecular Formula:
C12H14ClN3OS
Molecular Weight:
283.7771
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Product Description
Catalog Number:
AG01AG58
Chemical Name:
4-[(3-tert-butyl-1,2,4-thiadiazol-5-yl)oxy]-3-chloroaniline
CAS Number:
1482722-68-8
Molecular Formula:
C12H14ClN3OS
Molecular Weight:
283.7771
MDL Number:
MFCD20784298
IUPAC Name:
4-[(3-tert-butyl-1,2,4-thiadiazol-5-yl)oxy]-3-chloroaniline
InChI:
InChI=1S/C12H14ClN3OS/c1-12(2,3)10-15-11(18-16-10)17-9-5-4-7(14)6-8(9)13/h4-6H,14H2,1-3H3
InChI Key:
WPUCWIJBRFURPY-UHFFFAOYSA-N
SMILES:
Nc1ccc(c(c1)Cl)Oc1snc(n1)C(C)(C)C
Properties
Complexity:
287  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
283.055g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
283.774g/mol
Monoisotopic Mass:
283.055g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
89.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.3  
Properties