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Home > Boronic Acids > 953411-03-5
953411-03-5 | 1H-Indole-1,4-dicarboxylicacid, 2-borono-, 1-(1,1-dimethylethyl) 4-methyl ester
CAS No: 953411-03-5 Catalog No: AG00IIZS MDL No:
Product Description
Catalog Number:
AG00IIZS
Chemical Name:
1H-Indole-1,4-dicarboxylicacid, 2-borono-, 1-(1,1-dimethylethyl) 4-methyl ester
CAS Number:
953411-03-5
IUPAC Name:
[4-methoxycarbonyl-1-[(2-methylpropan-2-yl)oxycarbonyl]indol-2-yl]boronic acid
InChI:
InChI=1S/C15H18BNO6/c1-15(2,3)23-14(19)17-11-7-5-6-9(13(18)22-4)10(11)8-12(17)16(20)21/h5-8,20-21H,1-4H3
InChI Key:
WNDIMVXXLXLEPA-UHFFFAOYSA-N
Properties
Complexity:
463
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
319.123g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
319.12g/mol
Monoisotopic Mass:
319.123g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
98A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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