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Home > Boronic Acids > 1028748-11-9
1028748-11-9 | (2-methyl-2,3-dihydro-1-benzofuran-5-yl)boronic acid
CAS No: 1028748-11-9 Catalog No: AG008VBC MDL No:MFCD11634366
Product Description
Catalog Number:
AG008VBC
Chemical Name:
(2-methyl-2,3-dihydro-1-benzofuran-5-yl)boronic acid
CAS Number:
1028748-11-9
Molecular Formula:
C9H11BO3
Molecular Weight:
177.9928
MDL Number:
MFCD11634366
IUPAC Name:
(2-methyl-2,3-dihydro-1-benzofuran-5-yl)boronic acid
InChI:
InChI=1S/C9H11BO3/c1-6-4-7-5-8(10(11)12)2-3-9(7)13-6/h2-3,5-6,11-12H,4H2,1H3
InChI Key:
BUNVVERIGKVWLT-UHFFFAOYSA-N
SMILES:
CC1Oc2c(C1)cc(cc2)B(O)O
Properties
Complexity:
186
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
178.08g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
177.994g/mol
Monoisotopic Mass:
178.08g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
49.7A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
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