Home Other Building Blocks 2-BROMO-1-(2-(TERT-BUTYL)THIAZOL-4-YL)ETHANONE

2-BROMO-1-(2-(TERT-BUTYL)THIAZOL-4-YL)ETHANONE

CAS No.:
1823558-00-4
Catalog Number:
AG01DZ29
Molecular Formula:
C9H12BrNOS
Molecular Weight:
262.1667
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Product Description
Catalog Number:
AG01DZ29
Chemical Name:
2-BROMO-1-(2-(TERT-BUTYL)THIAZOL-4-YL)ETHANONE
CAS Number:
1823558-00-4
Molecular Formula:
C9H12BrNOS
Molecular Weight:
262.1667
MDL Number:
MFCD28141669
IUPAC Name:
2-bromo-1-(2-tert-butyl-1,3-thiazol-4-yl)ethanone
InChI:
InChI=1S/C9H12BrNOS/c1-9(2,3)8-11-6(5-13-8)7(12)4-10/h5H,4H2,1-3H3
InChI Key:
GOXNDQHKXCEYAE-UHFFFAOYSA-N
SMILES:
BrCC(=O)c1csc(n1)C(C)(C)C
Properties
Complexity:
202  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
260.982g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
262.165g/mol
Monoisotopic Mass:
260.982g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
58.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5  
Properties