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1003042-50-9 | Boronic acid, B-(5-amino-2-methylphenyl)-
CAS No: 1003042-50-9 Catalog No: AG0001JQ MDL No:MFCD22192389
Product Description
Catalog Number:
AG0001JQ
Chemical Name:
Boronic acid, B-(5-amino-2-methylphenyl)-
CAS Number:
1003042-50-9
Molecular Formula:
C7H10BNO2
Molecular Weight:
150.9708
MDL Number:
MFCD22192389
IUPAC Name:
(5-amino-2-methylphenyl)boronic acid
InChI:
InChI=1S/C7H10BNO2/c1-5-2-3-6(9)4-7(5)8(10)11/h2-4,10-11H,9H2,1H3
InChI Key:
JAHYXGDCVKUSTM-UHFFFAOYSA-N
SMILES:
Nc1ccc(c(c1)B(O)O)C
Properties
Complexity:
132
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
151.08g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
150.972g/mol
Monoisotopic Mass:
151.08g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
66.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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