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Home > Boronic Acids > 4347-31-3
4347-31-3 | (2-Formylthiophen-3-yl)boronic acid
CAS No: 4347-31-3 Catalog No: AG003BND MDL No:MFCD01075678
Product Description
Catalog Number:
AG003BND
Chemical Name:
(2-Formylthiophen-3-yl)boronic acid
CAS Number:
4347-31-3
Molecular Formula:
C5H5BO3S
Molecular Weight:
155.9674
MDL Number:
MFCD01075678
IUPAC Name:
(2-formylthiophen-3-yl)boronic acid
InChI:
InChI=1S/C5H5BO3S/c7-3-5-4(6(8)9)1-2-10-5/h1-3,8-9H
InChI Key:
BBENFHSYKBYWJX-UHFFFAOYSA-N
SMILES:
O=Cc1sccc1B(O)O
Properties
Complexity:
130
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
156.005g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
155.962g/mol
Monoisotopic Mass:
156.005g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
85.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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