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Home > Boronic Acids > 1245816-07-2

1245816-07-2

1245816-07-2 | Boronic acid, B-(7-methyl-1H-indazol-5-yl)-

CAS No: 1245816-07-2 Catalog No: AG000MFA MDL No:MFCD12028646

Product Description

Catalog Number:
AG000MFA
Chemical Name:
Boronic acid, B-(7-methyl-1H-indazol-5-yl)-
CAS Number:
1245816-07-2
Molecular Formula:
C8H9BN2O2
Molecular Weight:
175.9803
MDL Number:
MFCD12028646
IUPAC Name:
(7-methyl-1H-indazol-5-yl)boronic acid
InChI:
InChI=1S/C8H9BN2O2/c1-5-2-7(9(12)13)3-6-4-10-11-8(5)6/h2-4,12-13H,1H3,(H,10,11)
InChI Key:
OASKWOXPDMPOON-UHFFFAOYSA-N
SMILES:
OB(c1cc(C)c2c(c1)cn[nH]2)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:
3  
Isotope Atom Count:
0
Molecular Weight:
175.982g/mol
Monoisotopic Mass:
176.076g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
69.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0

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