Home Halogens methyl 2-(5-bromo-1,3-thiazol-2-yl)acetate

methyl 2-(5-bromo-1,3-thiazol-2-yl)acetate

CAS No.:
1375065-91-0
Catalog Number:
AG01ABZW
Molecular Formula:
C6H6BrNO2S
Molecular Weight:
236.0863
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Product Description
Catalog Number:
AG01ABZW
Chemical Name:
methyl 2-(5-bromo-1,3-thiazol-2-yl)acetate
CAS Number:
1375065-91-0
Molecular Formula:
C6H6BrNO2S
Molecular Weight:
236.0863
MDL Number:
MFCD14706346
IUPAC Name:
methyl 2-(5-bromo-1,3-thiazol-2-yl)acetate
InChI:
InChI=1S/C6H6BrNO2S/c1-10-6(9)2-5-8-3-4(7)11-5/h3H,2H2,1H3
InChI Key:
HBRYMHKKLRQFBO-UHFFFAOYSA-N
SMILES:
COC(=O)Cc1ncc(s1)Br
Properties
Complexity:
156  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
234.93g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
236.083g/mol
Monoisotopic Mass:
234.93g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
67.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8  
Properties