Home Halogens 4-bromo-2-(tert-butyl)thiazole

4-bromo-2-(tert-butyl)thiazole

CAS No.:
959238-21-2
Catalog Number:
AG01CA52
Molecular Formula:
C7H10BrNS
Molecular Weight:
220.1300
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Product Description
Catalog Number:
AG01CA52
Chemical Name:
4-bromo-2-(tert-butyl)thiazole
CAS Number:
959238-21-2
Molecular Formula:
C7H10BrNS
Molecular Weight:
220.1300
MDL Number:
MFCD09878992
IUPAC Name:
4-bromo-2-tert-butyl-1,3-thiazole
InChI:
InChI=1S/C7H10BrNS/c1-7(2,3)6-9-5(8)4-10-6/h4H,1-3H3
InChI Key:
MBCNEXNLPXCWIP-UHFFFAOYSA-N
SMILES:
CC(c1scc(n1)Br)(C)C
Properties
Complexity:
121  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
218.972g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
220.128g/mol
Monoisotopic Mass:
218.972g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
41.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7  
Properties