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Home > Bromides > 1006598-64-6
1006598-64-6 | methyl 5-bromo-2-formylfuran-3-carboxylate
CAS No: 1006598-64-6 Catalog No: AG01EM7T MDL No:MFCD30729714
Product Description
Catalog Number:
AG01EM7T
Chemical Name:
methyl 5-bromo-2-formylfuran-3-carboxylate
CAS Number:
1006598-64-6
Molecular Formula:
C7H5BrO4
Molecular Weight:
233.0162
MDL Number:
MFCD30729714
IUPAC Name:
methyl 5-bromo-2-formylfuran-3-carboxylate
InChI:
InChI=1S/C7H5BrO4/c1-11-7(10)4-2-6(8)12-5(4)3-9/h2-3H,1H3
InChI Key:
FQKUUDQFLSMYBE-UHFFFAOYSA-N
SMILES:
COC(=O)c1cc(oc1C=O)Br
Properties
Complexity:
194
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
231.937g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
233.017g/mol
Monoisotopic Mass:
231.937g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
56.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
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