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Home > Boronic Acids > 690632-72-5
690632-72-5 | (5-Bromo-2,3-dihydrobenzofuran-7-yl);boronic acid
CAS No: 690632-72-5 Catalog No: AG006DJC MDL No:MFCD06200893
Product Description
Catalog Number:
AG006DJC
Chemical Name:
(5-Bromo-2,3-dihydrobenzofuran-7-yl);boronic acid
CAS Number:
690632-72-5
Molecular Formula:
C8H8BBrO3
Molecular Weight:
242.8623
MDL Number:
MFCD06200893
IUPAC Name:
(5-bromo-2,3-dihydro-1-benzofuran-7-yl)boronic acid
InChI:
InChI=1S/C8H8BBrO3/c10-6-3-5-1-2-13-8(5)7(4-6)9(11)12/h3-4,11-12H,1-2H2
InChI Key:
BSSWVOKZPQTKGW-UHFFFAOYSA-N
SMILES:
Brc1cc(B(O)O)c2c(c1)CCO2
Properties
Complexity:
190
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
241.975g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
242.863g/mol
Monoisotopic Mass:
241.975g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
49.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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