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Home > Boronic Acids > 1001907-57-8

1001907-57-8

1001907-57-8 | Boronic acid, B-(2-methyl-2H-indazol-6-yl)-

CAS No: 1001907-57-8 Catalog No: AG00016L MDL No:MFCD09870057

Product Description

Catalog Number:
AG00016L
Chemical Name:
Boronic acid, B-(2-methyl-2H-indazol-6-yl)-
CAS Number:
1001907-57-8
Molecular Formula:
C8H9BN2O2
Molecular Weight:
175.9803
MDL Number:
MFCD09870057
IUPAC Name:
(2-methylindazol-6-yl)boronic acid
InChI:
InChI=1S/C8H9BN2O2/c1-11-5-6-2-3-7(9(12)13)4-8(6)10-11/h2-5,12-13H,1H3
InChI Key:
JADBVQWCMHPPQA-UHFFFAOYSA-N
SMILES:
Cn1cc2c(n1)cc(cc2)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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