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Home > Boronic Acids > 352530-25-7
352530-25-7 | (5-Formyl-4-methylthiophen-2-yl)boronic acid
CAS No: 352530-25-7 Catalog No: AG003BY4 MDL No:MFCD03093890
Product Description
Catalog Number:
AG003BY4
Chemical Name:
(5-Formyl-4-methylthiophen-2-yl)boronic acid
CAS Number:
352530-25-7
Molecular Formula:
C6H7BO3S
Molecular Weight:
169.9940
MDL Number:
MFCD03093890
IUPAC Name:
(5-formyl-4-methylthiophen-2-yl)boronic acid
InChI:
InChI=1S/C6H7BO3S/c1-4-2-6(7(9)10)11-5(4)3-8/h2-3,9-10H,1H3
InChI Key:
QEIXJCOHLUKRPO-UHFFFAOYSA-N
SMILES:
O=Cc1sc(cc1C)B(O)O
Properties
Complexity:
153
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
170.021g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
169.989g/mol
Monoisotopic Mass:
170.021g/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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