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Home > Boronic Acids > 191162-40-0
191162-40-0 | Boronic acid, B-(1-methyl-1H-indol-2-yl)-
CAS No: 191162-40-0 Catalog No: AG002F3C MDL No:MFCD01114668
Product Description
Catalog Number:
AG002F3C
Chemical Name:
Boronic acid, B-(1-methyl-1H-indol-2-yl)-
CAS Number:
191162-40-0
Molecular Formula:
C9H10BNO2
Molecular Weight:
174.9922
MDL Number:
MFCD01114668
IUPAC Name:
(1-methylindol-2-yl)boronic acid
InChI:
InChI=1S/C9H10BNO2/c1-11-8-5-3-2-4-7(8)6-9(11)10(12)13/h2-6,12-13H,1H3
InChI Key:
CBPBJUTWVXLSER-UHFFFAOYSA-N
SMILES:
OB(c1cc2c(n1C)cccc2)O
Properties
Complexity:
189
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
175.08g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
174.994g/mol
Monoisotopic Mass:
175.08g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
45.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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