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Home > Boronic Acids > 1351859-39-6
1351859-39-6 | 3-Bromo-5-methylthiophene-2-boronic acid
CAS No: 1351859-39-6 Catalog No: AG007ZOW MDL No:MFCD18311829
Product Description
Catalog Number:
AG007ZOW
Chemical Name:
3-Bromo-5-methylthiophene-2-boronic acid
CAS Number:
1351859-39-6
Molecular Formula:
C5H6BBrO2S
Molecular Weight:
220.8799
MDL Number:
MFCD18311829
IUPAC Name:
(3-bromo-5-methylthiophen-2-yl)boronic acid
InChI:
InChI=1S/C5H6BBrO2S/c1-3-2-4(7)5(10-3)6(8)9/h2,8-9H,1H3
InChI Key:
MJENRTSJWSKNLP-UHFFFAOYSA-N
SMILES:
Cc1cc(c(s1)B(O)O)Br
Properties
Complexity:
124
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
219.936g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
220.875g/mol
Monoisotopic Mass:
219.936g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
68.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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