Home Halogens ethyl 4-bromo-3-methylthiophene-2-carboxylate

ethyl 4-bromo-3-methylthiophene-2-carboxylate

CAS No.:
265652-37-7
Catalog Number:
AG01EL58
Molecular Formula:
C8H9BrO2S
Molecular Weight:
249.1249
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Product Description
Catalog Number:
AG01EL58
Chemical Name:
ethyl 4-bromo-3-methylthiophene-2-carboxylate
CAS Number:
265652-37-7
Molecular Formula:
C8H9BrO2S
Molecular Weight:
249.1249
MDL Number:
MFCD26386952
IUPAC Name:
ethyl 4-bromo-3-methylthiophene-2-carboxylate
InChI:
InChI=1S/C8H9BrO2S/c1-3-11-8(10)7-5(2)6(9)4-12-7/h4H,3H2,1-2H3
InChI Key:
BYPDJDUQFBZTNI-UHFFFAOYSA-N
SMILES:
Cc1c(scc1Br)C(=O)OCC
Properties
Complexity:
174  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
247.951g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
249.122g/mol
Monoisotopic Mass:
247.951g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
54.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2  
Properties