Home Halogens methyl 5-bromofuran-3-carboxylate

methyl 5-bromofuran-3-carboxylate

CAS No.:
197846-08-5
Catalog Number:
AG01C15N
Molecular Formula:
C6H5BrO3
Molecular Weight:
205.0061
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Product Description
Catalog Number:
AG01C15N
Chemical Name:
methyl 5-bromofuran-3-carboxylate
CAS Number:
197846-08-5
Molecular Formula:
C6H5BrO3
Molecular Weight:
205.0061
MDL Number:
MFCD18425997
IUPAC Name:
methyl 5-bromofuran-3-carboxylate
InChI:
InChI=1S/C6H5BrO3/c1-9-6(8)4-2-5(7)10-3-4/h2-3H,1H3
InChI Key:
DDCVXKKLSQNHIK-UHFFFAOYSA-N
SMILES:
COC(=O)c1coc(c1)Br
Properties
Complexity:
137  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
203.942g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
205.007g/mol
Monoisotopic Mass:
203.942g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
39.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9  
Properties