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Home > Boronic Acids > 1001907-56-7
1001907-56-7 | Boronic acid, B-(2-methyl-2H-indazol-4-yl)-
CAS No: 1001907-56-7 Catalog No: AG00016M MDL No:MFCD09870055
Product Description
Catalog Number:
AG00016M
Chemical Name:
Boronic acid, B-(2-methyl-2H-indazol-4-yl)-
CAS Number:
1001907-56-7
Molecular Formula:
C8H9BN2O2
Molecular Weight:
175.9803
MDL Number:
MFCD09870055
IUPAC Name:
(2-methylindazol-4-yl)boronic acid
InChI:
InChI=1S/C8H9BN2O2/c1-11-5-6-7(9(12)13)3-2-4-8(6)10-11/h2-5,12-13H,1H3
InChI Key:
KLESGUYTRALUBQ-UHFFFAOYSA-N
SMILES:
Cn1nc2c(c1)c(ccc2)B(O)O
Properties
Complexity:
191
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
176.076g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
175.982g/mol
Monoisotopic Mass:
176.076g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
58.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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