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Home > Boronic Acids > 120095-48-9
120095-48-9 | 1,3,2-Benzodioxaborole, 4-methyl-
CAS No: 120095-48-9 Catalog No: AG000QA0 MDL No:
Product Description
Catalog Number:
AG000QA0
Chemical Name:
1,3,2-Benzodioxaborole, 4-methyl-
CAS Number:
120095-48-9
Molecular Formula:
C7H7BO2
Molecular Weight:
133.9403
IUPAC Name:
4-methyl-1,3,2λ2-benzodioxaborole
InChI:
InChI=1S/C7H6BO2/c1-5-3-2-4-6-7(5)10-8-9-6/h2-4H,1H3
InChI Key:
JKVVJLQZSNHQLN-UHFFFAOYSA-N
SMILES:
Cc1cccc2c1OBO2
Properties
Complexity:
129
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
133.046g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
132.933g/mol
Monoisotopic Mass:
133.046g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
18.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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