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Home > Boronic Acids > 1256358-93-6
1256358-93-6 | 5-Methylindole-2-boronic acid pinacol ester
CAS No: 1256358-93-6 Catalog No: AG009IPX MDL No:MFCD11858361
Product Description
Catalog Number:
AG009IPX
Chemical Name:
5-Methylindole-2-boronic acid pinacol ester
CAS Number:
1256358-93-6
Molecular Formula:
C15H20BNO2
Molecular Weight:
257.1358
MDL Number:
MFCD11858361
IUPAC Name:
5-methyl-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-indole
InChI:
InChI=1S/C15H20BNO2/c1-10-6-7-12-11(8-10)9-13(17-12)16-18-14(2,3)15(4,5)19-16/h6-9,17H,1-5H3
InChI Key:
RNRIKENXTSRARN-UHFFFAOYSA-N
SMILES:
Cc1ccc2c(c1)cc([nH]2)B1OC(C(O1)(C)C)(C)C
Properties
Complexity:
342
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
257.159g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
257.14g/mol
Monoisotopic Mass:
257.159g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
34.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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