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Home > Boronic Acids > 1310405-36-7
1310405-36-7 | Boronic acid, B-(1,4-dimethyl-1H-indazol-5-yl)-
CAS No: 1310405-36-7 Catalog No: AG000VFO MDL No:MFCD12028655
Product Description
Catalog Number:
AG000VFO
Chemical Name:
Boronic acid, B-(1,4-dimethyl-1H-indazol-5-yl)-
CAS Number:
1310405-36-7
Molecular Formula:
C9H11BN2O2
Molecular Weight:
190.0068
MDL Number:
MFCD12028655
IUPAC Name:
(1,4-dimethylindazol-5-yl)boronic acid
InChI:
InChI=1S/C9H11BN2O2/c1-6-7-5-11-12(2)9(7)4-3-8(6)10(13)14/h3-5,13-14H,1-2H3
InChI Key:
ATHVOUQWKYPARY-UHFFFAOYSA-N
SMILES:
OB(c1ccc2c(c1C)cnn2C)O
Properties
Complexity:
215
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
190.091g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
190.009g/mol
Monoisotopic Mass:
190.091g/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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