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Home > Boronic Acids > 182133-35-3
182133-35-3 | Boronic acid, B-(6-methoxybenzo[b]thien-2-yl)-
CAS No: 182133-35-3 Catalog No: AG0023F2 MDL No:MFCD09952075
Product Description
Catalog Number:
AG0023F2
Chemical Name:
Boronic acid, B-(6-methoxybenzo[b]thien-2-yl)-
CAS Number:
182133-35-3
Molecular Formula:
C9H9BO3S
Molecular Weight:
208.0420
MDL Number:
MFCD09952075
IUPAC Name:
(6-methoxy-1-benzothiophen-2-yl)boronic acid
InChI:
InChI=1S/C9H9BO3S/c1-13-7-3-2-6-4-9(10(11)12)14-8(6)5-7/h2-5,11-12H,1H3
InChI Key:
PNRDOYJXKKKYSU-UHFFFAOYSA-N
SMILES:
COc1ccc2c(c1)sc(c2)B(O)O
Properties
Complexity:
203
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
208.037g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
208.038g/mol
Monoisotopic Mass:
208.037g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
77.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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