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Home > Boronic Acids > 913388-58-6
913388-58-6 | 1H-Indole-1,5-dicarboxylic acid, 2-borono-, 1-(1,1-dimethylethyl) ester
CAS No: 913388-58-6 Catalog No: AG00IGLL MDL No:
Product Description
Catalog Number:
AG00IGLL
Chemical Name:
1H-Indole-1,5-dicarboxylic acid, 2-borono-, 1-(1,1-dimethylethyl) ester
CAS Number:
913388-58-6
IUPAC Name:
2-borono-1-[(2-methylpropan-2-yl)oxycarbonyl]indole-5-carboxylic acid
InChI:
InChI=1S/C14H16BNO6/c1-14(2,3)22-13(19)16-10-5-4-8(12(17)18)6-9(10)7-11(16)15(20)21/h4-7,20-21H,1-3H3,(H,17,18)
InChI Key:
SSIOKSWXLIBVRA-UHFFFAOYSA-N
Properties
Complexity:
449
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
305.107g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
305.093g/mol
Monoisotopic Mass:
305.107g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
109A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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