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Home > Bromides > 1389313-67-0
1389313-67-0 | Methyl 5-Bromo-3-iodo-2-thiophenecarboxylate
CAS No: 1389313-67-0 Catalog No: AG01FANS MDL No:MFCD22380016
Product Description
Catalog Number:
AG01FANS
Chemical Name:
Methyl 5-Bromo-3-iodo-2-thiophenecarboxylate
CAS Number:
1389313-67-0
Molecular Formula:
C6H4BrIO2S
Molecular Weight:
346.9682
MDL Number:
MFCD22380016
IUPAC Name:
methyl 5-bromo-3-iodothiophene-2-carboxylate
InChI:
InChI=1S/C6H4BrIO2S/c1-10-6(9)5-3(8)2-4(7)11-5/h2H,1H3
InChI Key:
RUCGHVXFPJVDHB-UHFFFAOYSA-N
SMILES:
COC(=O)c1sc(cc1I)Br
Properties
Complexity:
167
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
345.816g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
346.964g/mol
Monoisotopic Mass:
345.816g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
54.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5
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